A0A078BS27_CAEEL Loading...

Zc3h12a-like Ribonuclease NYN domain-containing protein

AlphaFold DB , UniProt , Accession A0A078BS27, Species CAEEL (Caenorhabditis elegans), Gene eri-9, Length 664 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.7	Very low	24	Very low	237 Å²	237	159.5 Å²	159.5	100%	1.167	86%	0.863	S	S	*	*				0	171.8	0	-82.9	-174.1	165.6	0	0	109.1
2	S	23.8	Very low	24	Very low	120 Å²	120	161 Å²	161	84%	0.839	86%	0.861	S	S	*	*			trans	46.9	92.6	172.9	58.2	0	0	0	0	116.4
3	G	22.3	Very low	24.1	Very low	79 Å²	79	159.4 Å²	159.4	81%	0.814	85%	0.852	S	S	*	*			trans	-88.8	168.6	158.9	0	0	0	0	0	111.6
4	V	22.2	Very low	24	Very low	141 Å²	141	164.8 Å²	164.8	86%	0.855	86%	0.857	S	S	*	*			trans	-127.8	133.8	167.1	178.4	0	0	0	0	107.9
5	Q	24.4	Very low	24.3	Very low	184 Å²	184	161.2 Å²	161.2	86%	0.86	85%	0.848	S	S	*	*			trans	-129.9	118.3	-172.3	-176.3	-175.3	22.1	0	0	108.9
6	L	22.1	Very low	24.4	Very low	160 Å²	160	164.8 Å²	164.8	84%	0.838	85%	0.848	S	S	*	*			trans	-133.1	95	178.1	-80.6	175.2	0	0	0	112.5
7	S	22.6	Very low	24.9	Very low	93 Å²	93	161.5 Å²	161.5	65%	0.65	84%	0.84	S	S	*	*			trans	32.6	101.4	143.1	-175.4	0	0	0	0	119	R9	S7-R9 PolarHBondContact O-N 2.79Å
8	L	26.6	Very low	24.8	Very low	179 Å²	179	159.7 Å²	159.7	94%	0.937	84%	0.842	S	S	*	*			trans	-66.5	124	150.2	-83	157.8	0	0	0	110.4
9	R	22.8	Very low	24.7	Very low	211 Å²	211	157.3 Å²	157.3	80%	0.796	85%	0.848	S	S	*	*			trans	-141.6	161.1	158.5	-81.4	-163.3	174.6	-173	-2	110.4	S7	S7-R9 PolarHBondContact O-N 2.79Å
10	D	25.3	Very low	24.8	Very low	156 Å²	156	154.1 Å²	154.1	83%	0.834	84%	0.843	S	S	*	*			trans	67.3	58.6	165.9	-50.8	-17.6	0	0	0	117.3
11	Q	25.9	Very low	24.8	Very low	194 Å²	194	152.1 Å²	152.1	91%	0.907	84%	0.841	S	S	*	*			trans	-112.5	106.8	144.4	-82	-166.2	-10.2	0	0	110.2
12	Q	24.3	Very low	24.8	Very low	178 Å²	178	149.7 Å²	149.7	83%	0.832	83%	0.826	S	S	*	*			trans	-145.8	154.5	160.9	-74.1	-162.1	-16	0	0	111.4
13	N	25.4	Very low	24.9	Very low	140 Å²	140	147 Å²	147	75%	0.749	81%	0.805	S	S	*	*			trans	73.4	74.3	164.3	-57.5	-24.7	0	0	0	119.4
14	Y	23.5	Very low	25.2	Very low	235 Å²	235	148.3 Å²	148.3	92%	0.922	80%	0.797	S	S	*	*			trans	-141.3	136.9	131.6	-94.1	-76	0	0	0	109.8
15	P	28.6	Very low	25.4	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	78%	0.779	S	S	*	*			trans	-92.5	133.6	-174.4	33.8	-33.4	0	0	0	114.6
16	Y	25	Very low	25.5	Very low	218 Å²	218	143.9 Å²	143.9	86%	0.855	77%	0.769	S	S	*	*			trans	10.1	159.8	149.7	-69.8	-68	0	0	0	123.2
17	P	32.6	Very low	25.6	Very low	109 Å²	109	142.4 Å²	142.4	71%	0.708	76%	0.761	S	S	*	*			cis	-134.7	147.1	-17.4	33.7	-15.7	0	0	0	115.4
18	C	22.8	Very low	25.7	Very low	130 Å²	130	146.1 Å²	146.1	88%	0.878	76%	0.762	S	S	*	*			trans	-147.6	147	147.3	-94.1	0	0	0	0	108.4	A20	C18-A20 PolarHBondContact O-N 3.38Å; C18-A20 VanDerWaalsContact O-N 3.12Å
19	A	24.1	Very low	25.5	Very low	114 Å²	114	144 Å²	144	94%	0.942	75%	0.752	S	S	*	*			trans	-76	102.3	-170.9	0	0	0	0	0	111.8
20	A	25.6	Very low	25.9	Very low	92 Å²	92	139.8 Å²	139.8	76%	0.76	76%	0.755	S	S	*	*			trans	-93.1	115.1	171.9	0	0	0	0	0	110.4	C18 Q22	C18-A20 PolarHBondContact O-N 3.38Å; C18-A20 VanDerWaalsContact O-N 3.12Å; A20-Q22 PolarHBondContact O-N 2.72Å
21	S	25.6	Very low	25.8	Very low	113 Å²	113	138 Å²	138	79%	0.79	74%	0.742	S	S	*	*			trans	-70.1	113.1	166.6	40.1	0	0	0	0	109.4	V23	S21-V23 PolarHBondContact O-N 3.31Å
22	Q	25.3	Very low	25.8	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	73%	0.726	S	S	*	*			trans	-67.5	127.5	178	-70.3	-176.1	-14.3	0	0	110.3	A20	A20-Q22 PolarHBondContact O-N 2.72Å
23	V	26.6	Very low	26	Very low	64 Å²	64	131.1 Å²	131.1	39%	0.388	71%	0.707	S	S	.	*			trans	-112.7	114.6	173.3	-177.3	0	0	0	0	108.2	S21 F25	S21-V23 PolarHBondContact O-N 3.31Å; V23-F25 HydrophobicContact CB-CE2 4.31Å; V23-F25 HydrophobicContact CB-CZ 4.34Å; V23-F25 HydrophobicContact CG1-CD1 4.44Å; V23-F25 HydrophobicContact CG1-CD2 4.41Å; V23-F25 HydrophobicContact CG1-CE1 3.84Å; V23-F25 HydrophobicContact CG1-CE2 3.8Å; V23-F25 HydrophobicContact CG1-CZ 3.49Å; V23-F25 VanDerWaalsContact CG1-CZ 3.49Å
24	T	27.7	Very low	26	Very low	106 Å²	106	133.2 Å²	133.2	65%	0.65	70%	0.704	S	S	*	*			trans	-96.3	126.6	175.9	-52.2	0	0	0	0	109.4
25	F	27.6	Very low	26.2	Very low	110 Å²	110	128.9 Å²	128.9	48%	0.482	69%	0.69	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	135.1	175.2	-60.3	-79.6	0	0	0	110.2	V23 M32	V23-F25 HydrophobicContact CB-CE2 4.31Å; V23-F25 HydrophobicContact CB-CZ 4.34Å; V23-F25 HydrophobicContact CG1-CD1 4.44Å; V23-F25 HydrophobicContact CG1-CD2 4.41Å; V23-F25 HydrophobicContact CG1-CE1 3.84Å; V23-F25 HydrophobicContact CG1-CE2 3.8Å; V23-F25 HydrophobicContact CG1-CZ 3.49Å; V23-F25 VanDerWaalsContact CG1-CZ 3.49Å; F25-M32 HydrophobicContact CB-CG 4.38Å; F25-M32 HydrophobicContact CB-SD 4.38Å; F25-M32 HydrophobicContact CD1-CE 3.7Å; F25-M32 HydrophobicContact CD1-CG 3.98Å; F25-M32 HydrophobicContact CD1-SD 3.62Å; F25-M32 HydrophobicContact CE1-CE 3.65Å; F25-M32 HydrophobicContact CE1-SD 4.12Å; F25-M32 HydrophobicContact CG-SD 4.11Å
26	L	25.6	Very low	26	Very low	123 Å²	123	127.8 Å²	127.8	64%	0.644	68%	0.684	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.8	129.3	167.8	-84.1	165.1	0	0	0	109	Y33	L26-Y33 PolarHBondContact O-N 3.32Å
27	L	25.3	Very low	26	Very low	129 Å²	129	123.2 Å²	123.2	68%	0.675	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.4	130.2	169.5	-108.7	82.8	0	0	0	109.3	M32	L27-M32 HydrophobicContact CD1-CB 4.43Å; L27-M32 HydrophobicContact CD1-CG 4.24Å
28	Y	23.7	Very low	25.6	Very low	171 Å²	171	121.9 Å²	121.9	67%	0.671	68%	0.677	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-143.2	133.7	166.7	-158.5	-98.8	0	0	0	109.1	S30 Q31	Y28-S30 VanDerWaalsContact C-N 3.27Å; Y28-S30 PolarHBondContact O-N 3.06Å; Y28-S30 VanDerWaalsContact O-N 3.16Å; Y28-Q31 PolarHBondContact N-O 3.29Å; Y28-Q31 PolarHBondContact O-N 2.76Å; Y28-Q31 VanDerWaalsContact O-N 3.07Å
29	N	22.9	Very low	25.6	Very low	134 Å²	134	123.5 Å²	123.5	72%	0.717	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	42.1	49.5	-176.5	-67	-7.2	0	0	0	114.4	Q31	N29-Q31 PolarHBondContact O-N 2.71Å; N29-Q31 VanDerWaalsContact O-N 3.09Å
30	S	30	Very low	25.7	Very low	123 Å²	123	123.1 Å²	123.1	86%	0.86	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.4	16.8	177.1	-55.1	0	0	0	0	116.1	Y28	Y28-S30 VanDerWaalsContact C-N 3.27Å; Y28-S30 PolarHBondContact O-N 3.06Å; Y28-S30 VanDerWaalsContact O-N 3.16Å
31	Q	25	Very low	25.7	Very low	119 Å²	119	125 Å²	125	56%	0.556	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.9	142	170	-66.6	-178.5	-7.1	0	0	110	Y28 N29 Y33	Y28-Q31 PolarHBondContact N-O 3.29Å; Y28-Q31 PolarHBondContact O-N 2.76Å; Y28-Q31 VanDerWaalsContact O-N 3.07Å; N29-Q31 PolarHBondContact O-N 2.71Å; N29-Q31 VanDerWaalsContact O-N 3.09Å; Q31-Y33 HydrophobicContact CB-CD2 4.44Å; Q31-Y33 HydrophobicContact CB-CE2 3.72Å; Q31-Y33 PolarHBondContact OE1-OH 2.79Å
32	M	25.1	Very low	25.6	Very low	116 Å²	116	124.1 Å²	124.1	57%	0.571	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.6	106.1	-177.9	-169.9	-175.1	76.7	0	0	109.9	F25 L27	F25-M32 HydrophobicContact CB-CG 4.38Å; F25-M32 HydrophobicContact CB-SD 4.38Å; F25-M32 HydrophobicContact CD1-CE 3.7Å; F25-M32 HydrophobicContact CD1-CG 3.98Å; F25-M32 HydrophobicContact CD1-SD 3.62Å; F25-M32 HydrophobicContact CE1-CE 3.65Å; F25-M32 HydrophobicContact CE1-SD 4.12Å; F25-M32 HydrophobicContact CG-SD 4.11Å; L27-M32 HydrophobicContact CD1-CB 4.43Å; L27-M32 HydrophobicContact CD1-CG 4.24Å
33	Y	27.8	Very low	25.8	Very low	111 Å²	111	122.3 Å²	122.3	44%	0.435	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.6	125	-177	-67.7	-92.3	0	0	0	110.8	L26 Q31	L26-Y33 PolarHBondContact O-N 3.32Å; Q31-Y33 HydrophobicContact CB-CD2 4.44Å; Q31-Y33 HydrophobicContact CB-CE2 3.72Å; Q31-Y33 PolarHBondContact OE1-OH 2.79Å
34	R	26.6	Very low	25.7	Very low	184 Å²	184	124.3 Å²	124.3	69%	0.694	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96	103.1	176	-179.4	-177.4	176.6	172.9	1.2	109.8
35	F	25.9	Very low	25.7	Very low	143 Å²	143	128 Å²	128	63%	0.627	69%	0.689	S	S	*	*			trans	-94.4	121.6	169.5	-69.6	-84.6	0	0	0	110.3
36	C	25	Very low	25.6	Very low	88 Å²	88	130 Å²	130	60%	0.595	71%	0.705	S	S	*	*			trans	-106.8	101.3	166	-71	0	0	0	0	108	A38	C36-A38 PolarHBondContact O-N 3.24Å; C36-A38 VanDerWaalsContact O-N 3.08Å
37	V	25.1	Very low	25.6	Very low	122 Å²	122	131.1 Å²	131.1	74%	0.739	71%	0.707	S	S	*	*			trans	-73.2	99.8	172.1	-180	0	0	0	0	107.9	L39	V37-L39 HydrophobicContact CG1-CD2 4.46Å; V37-L39 HydrophobicContact CG1-CG 4.44Å; V37-L39 PolarHBondContact O-N 3.3Å; V37-L39 VanDerWaalsContact O-N 3.13Å
38	A	24.2	Very low	25.5	Very low	82 Å²	82	132.3 Å²	132.3	68%	0.678	71%	0.709	S	S	*	*			trans	-73.2	99.4	170	0	0	0	0	0	108.9	C36 T40	C36-A38 PolarHBondContact O-N 3.24Å; C36-A38 VanDerWaalsContact O-N 3.08Å; A38-T40 PolarHBondContact O-N 3.38Å
39	L	24	Very low	25.5	Very low	163 Å²	163	129.6 Å²	129.6	85%	0.853	71%	0.71	S	S	*	*			trans	-71.4	79.9	166.1	-73.6	174.5	0	0	0	109.2	V37	V37-L39 HydrophobicContact CG1-CD2 4.46Å; V37-L39 HydrophobicContact CG1-CG 4.44Å; V37-L39 PolarHBondContact O-N 3.3Å; V37-L39 VanDerWaalsContact O-N 3.13Å
40	T	25.4	Very low	25.6	Very low	107 Å²	107	127.7 Å²	127.7	66%	0.656	70%	0.703	S	S	*	*			trans	-64.4	125	164.4	49.6	0	0	0	0	108.7	A38 S42	A38-T40 PolarHBondContact O-N 3.38Å; T40-S42 VanDerWaalsContact C-N 3.32Å; T40-S42 PolarHBondContact O-N 3.05Å
41	P	24.5	Very low	25.3	Very low	130 Å²	130	132 Å²	132	84%	0.844	70%	0.701	S	S	*	*			trans	-71.3	90.6	172.1	29.3	-33.1	0	0	0	109.2
42	S	25.4	Very low	25.3	Very low	96 Å²	96	134.4 Å²	134.4	67%	0.671	71%	0.709	S	S	*	*			trans	-71.7	124.3	171.8	51.8	0	0	0	0	110	T40 S44	T40-S42 VanDerWaalsContact C-N 3.32Å; T40-S42 PolarHBondContact O-N 3.05Å; S42-S44 PolarHBondContact O-N 2.86Å
43	T	28.1	Very low	25.3	Very low	147 Å²	147	133 Å²	133	90%	0.902	71%	0.711	S	S	*	*			trans	-71.6	113	168.4	48.3	0	0	0	0	110.1
44	S	25.7	Very low	25.1	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	73%	0.731	S	S	*	*			trans	-146.2	144.9	161.2	57.5	0	0	0	0	108.7	S42	S42-S44 PolarHBondContact O-N 2.86Å
45	E	26	Very low	24.9	Very low	184 Å²	184	137 Å²	137	86%	0.86	74%	0.738	S	S	*	*			trans	-86.1	176.3	-173.6	-65.9	171.5	119.2	0	0	112.7
46	D	25.7	Very low	25.6	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	74%	0.742	S	S	*	*			trans	87.5	147.5	148.8	-87.6	-27.6	0	0	0	124
47	E	26.1	Very low	25.6	Very low	148 Å²	148	135.9 Å²	135.9	69%	0.692	75%	0.753	S	S	*	*			trans	67.8	106.1	159	-60.4	-116.6	108.5	0	0	117.8
48	Q	23.6	Very low	25.6	Very low	154 Å²	154	135.8 Å²	135.8	72%	0.72	76%	0.757	S	S	*	*				81.4	138	90.3	-79.3	-147.2	73.6	0	0	114.1
49	V	23.7	Very low	25.6	Very low	114 Å²	114	141.1 Å²	141.1	69%	0.691	77%	0.765	S	S	*	*			cis	-167.9	175.3	-2.6	68.9	0	0	0	0	111.5
50	V	23.9	Very low	26.3	Very low	94 Å²	94	138.8 Å²	138.8	57%	0.57	76%	0.76	S	S	*	*			trans	84.1	104.2	153.9	157.8	0	0	0	0	121.4
51	R	24.5	Very low	26.7	Very low	214 Å²	214	139.1 Å²	139.1	81%	0.808	76%	0.764	S	S	*	*				63.9	157	125.6	-59.4	179.9	-174.3	150.3	1.2	120
52	K	24.8	Very low	26.9	Very low	168 Å²	168	139.3 Å²	139.3	73%	0.73	76%	0.763	S	S	*	*			cis	-164.8	161.8	0.9	-131.9	-176.5	177.6	-163.2	0	111.7
53	S	24.3	Very low	27.3	Very low	88 Å²	88	139.4 Å²	139.4	62%	0.615	76%	0.761	S	S	*	*			trans	57.4	147.2	146.5	57.5	0	0	0	0	120.6
54	E	24.7	Very low	27.1	Very low	182 Å²	182	139.7 Å²	139.7	85%	0.85	75%	0.752	S	S	*	*			cis	-156.8	-167.4	-2.5	-125.4	142.9	-128.7	0	0	113.5
55	K	23.4	Very low	27	Very low	195 Å²	195	140.2 Å²	140.2	85%	0.848	75%	0.751	S	S	*	*			trans	-139	-167.8	-171.4	-133	179	-178.1	177.2	0	107.6
56	P	40	Very low	26.9	Very low	110 Å²	110	140.4 Å²	140.4	71%	0.714	75%	0.752	S	S	*	*			cis	-142.1	-164.6	-12.5	40.4	-18.9	0	0	0	116.1
57	A	25.2	Very low	26.7	Very low	99 Å²	99	140.2 Å²	140.2	82%	0.818	75%	0.751	S	S	*	*			trans	79.6	157.6	152.1	0	0	0	0	0	119.1
58	S	24.3	Very low	26.5	Very low	119 Å²	119	137.6 Å²	137.6	83%	0.832	75%	0.748	S	S	*	*			cis	-145	-165.7	8.1	68.3	0	0	0	0	114.6
59	K	23.4	Very low	26.4	Very low	195 Å²	195	136 Å²	136	85%	0.848	75%	0.748	S	S	*	*			trans	-156	175.8	-174.2	-120.9	-164.9	173.3	-174.9	0	109.6
60	P	39.4	Very low	26.4	Very low	113 Å²	113	140.4 Å²	140.4	73%	0.734	76%	0.759	S	S	*	*			cis	-112.9	-114.8	-3.9	36.7	-15.2	0	0	0	112.3
61	P	34.4	Very low	26.5	Very low	114 Å²	114	140.6 Å²	140.6	74%	0.74	76%	0.764	S	S	*	*			cis	-128.9	-153.1	2.5	45.5	-26.1	0	0	0	115.3
62	T	27.7	Very low	26.6	Very low	135 Å²	135	136.8 Å²	136.8	83%	0.828	76%	0.756	S	S	*	*			trans	-150.5	178.7	174.5	3.5	0	0	0	0	109.3
63	P	34.5	Very low	26.7	Very low	98 Å²	98	136 Å²	136	64%	0.636	75%	0.752	S	S	*	*			cis	-136.6	-136.4	29.5	32.2	-4	0	0	0	114.3
64	E	23.1	Very low	26.8	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	76%	0.761	S	S	*	*			cis	-164.7	130.9	1.7	-145.1	61.7	-74.9	0	0	108
65	V	23.6	Very low	26.8	Very low	117 Å²	117	136.2 Å²	136.2	71%	0.709	75%	0.752	S	S	*	*				77.4	151.9	100.1	-168.6	0	0	0	0	119.3
66	E	24	Very low	27	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	74%	0.741	S	S	*	*			trans	80.4	152.2	174.7	-54	-165.3	170.9	0	0	120.5
67	D	22.2	Very low	26.4	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	74%	0.738	S	S	*	*			cis	-163.8	173.2	-46.3	-153.2	-5.3	0	0	0	113.5
68	C	21.6	Very low	26.6	Very low	93 Å²	93	138.8 Å²	138.8	63%	0.628	74%	0.736	S	S	*	*			trans	79.8	109.8	149.6	-77.3	0	0	0	0	127.3
69	T	22.9	Very low	26.6	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	73%	0.727	S	S	*	*				72.1	130.7	124.2	59.3	0	0	0	0	128.6
70	F	23.6	Very low	26.8	Very low	207 Å²	207	137.6 Å²	137.6	91%	0.908	72%	0.721	S	S	*	*			trans	59.9	155.2	144	-83.9	-99	0	0	0	121.2
71	S	24.2	Very low	26.2	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	72%	0.721	S	S	*	*			cis	-154.8	-164.6	2	61.6	0	0	0	0	109.7
72	E	27	Very low	25.9	Very low	134 Å²	134	142.6 Å²	142.6	63%	0.626	72%	0.722	S	S	*	*			cis	-168.1	172.2	-8.4	-140.2	-162.8	134.9	0	0	111
73	K	26.7	Very low	25.7	Very low	152 Å²	152	144.8 Å²	144.8	66%	0.661	72%	0.723	S	S	*	*			trans	62.3	159.2	154.9	-77.8	157.4	176.1	135.6	0	120.1
74	N	26.6	Very low	25.3	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	72%	0.717	S	S	*	*			cis	157.6	158.4	-20.1	-93.1	5	0	0	0	106
75	N	26	Very low	25.4	Very low	125 Å²	125	144.8 Å²	144.8	67%	0.668	72%	0.72	S	S	*	*			cis	-168.1	-170.3	-20.9	-170.2	39.3	0	0	0	109.1
76	D	26.2	Very low	25.4	Very low	116 Å²	116	143.3 Å²	143.3	62%	0.62	72%	0.715	S	S	*	*			trans	87.3	133.9	164.7	-60.1	-16.4	0	0	0	117.8
77	Q	27.5	Very low	25.5	Very low	139 Å²	139	142.7 Å²	142.7	65%	0.65	71%	0.712	S	S	*	*			cis	90.8	140.1	31.2	-72.8	-163.3	19.5	0	0	114.1
78	R	29.1	Very low	25.6	Very low	204 Å²	204	144.6 Å²	144.6	77%	0.77	72%	0.716	S	S	*	*			cis	-123.8	-153	5.9	-61.3	-176.8	179.2	91.7	25.6	109.5
79	K	25.9	Very low	25.8	Very low	150 Å²	150	144.6 Å²	144.6	65%	0.652	72%	0.717	S	S	*	*			cis	-153.8	177.5	6.5	-168.5	-124.3	172.5	178.7	0	108.8	E81	K79-E81 IonicContact NZ-OE1 2.67Å; K79-E81 PolarHBondContact NZ-OE1 3.43Å; K79-E81 IonicContact NZ-OE2 2.67Å; K79-E81 PolarHBondContact NZ-OE2 3.07Å
80	I	27.5	Very low	25.9	Very low	139 Å²	139	144.3 Å²	144.3	71%	0.713	72%	0.72	S	S	*	*			trans	-133.4	153.2	178.2	-66.8	167.6	0	0	0	109.9
81	E	26.2	Very low	25.9	Very low	160 Å²	160	140.5 Å²	140.5	75%	0.748	71%	0.709	S	S	*	*			trans	-142.5	163.6	149	-137.9	110.8	-110.4	0	0	109.2	K79	K79-E81 IonicContact NZ-OE1 2.67Å; K79-E81 PolarHBondContact NZ-OE1 3.43Å; K79-E81 IonicContact NZ-OE2 2.67Å; K79-E81 PolarHBondContact NZ-OE2 3.07Å
82	K	27	Very low	25.9	Very low	172 Å²	172	144.4 Å²	144.4	75%	0.748	72%	0.721	S	S	*	*			trans	-141.9	151.7	-172	-92.3	-169.1	170.5	-163.3	0	111.2
83	E	25.2	Very low	25.7	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	73%	0.728	S	S	*	*			trans	-172.5	125.3	134.5	-97.9	151.4	-155.2	0	0	105
84	T	25	Very low	25.7	Very low	84 Å²	84	148.8 Å²	148.8	52%	0.515	74%	0.739	S	S	.	*				62.9	127	53.8	71.1	0	0	0	0	113.1
85	E	25	Very low	26.1	Very low	167 Å²	167	147.1 Å²	147.1	78%	0.78	74%	0.736	S	S	*	*			cis	-159.2	-172.4	-3.8	-138.7	69.8	-77.7	0	0	106.3
86	S	24.2	Very low	26.4	Very low	86 Å²	86	146.8 Å²	146.8	60%	0.601	74%	0.741	S	S	*	*			cis	-160.4	-178.9	6.1	53.3	0	0	0	0	111.6
87	E	25.3	Very low	26.2	Very low	174 Å²	174	146.2 Å²	146.2	81%	0.813	75%	0.752	S	S	*	*			trans	19.4	148.1	136	-61.2	167.4	163.8	0	0	120.8
88	E	25.4	Very low	26	Very low	188 Å²	188	151.2 Å²	151.2	88%	0.879	77%	0.765	S	S	*	*			cis	-127.8	159.5	26.4	-64.5	176.4	124.8	0	0	112.8
89	S	24.4	Very low	26	Very low	92 Å²	92	146.1 Å²	146.1	64%	0.643	76%	0.758	S	S	*	*			cis	98.1	81.6	17.2	-166.8	0	0	0	0	117.2
90	S	26	Very low	25.9	Very low	114 Å²	114	144.3 Å²	144.3	80%	0.797	76%	0.764	S	S	*	*			trans	177.7	123.4	135.6	39.7	0	0	0	0	110.6
91	N	22.8	Very low	25.6	Very low	128 Å²	128	143.9 Å²	143.9	68%	0.684	76%	0.762	S	S	*	*				82.5	102.2	53.8	-81.4	-52.5	0	0	0	115.4
92	L	24.2	Very low	25.4	Very low	180 Å²	180	146.9 Å²	146.9	94%	0.942	77%	0.767	S	S	*	*			trans	-145.9	148.3	139.5	-114.4	164.7	0	0	0	109.5
93	K	23.5	Very low	25.3	Very low	178 Å²	178	145 Å²	145	77%	0.774	76%	0.764	S	S	*	*			trans	-113.5	149.8	-157.9	-60.5	175.4	177	172.5	0	113.6
94	F	26.1	Very low	25.1	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.873	76%	0.764	S	S	*	*			trans	-67.3	-175.3	151.4	-61.8	-89.4	0	0	0	110.4
95	P	35.5	Very low	25	Very low	114 Å²	114	143 Å²	143	74%	0.74	78%	0.776	S	S	*	*			cis	-132.8	-134.4	-1	44.2	-23.3	0	0	0	109.8
96	P	31.3	Very low	24.9	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	77%	0.774	S	S	*	*			cis	-128.1	158.6	-35	35.6	-20.3	0	0	0	114.9
97	A	23.6	Very low	24.8	Very low	103 Å²	103	146.7 Å²	146.7	85%	0.851	79%	0.785	S	S	*	*			trans	-155.1	142	152.1	0	0	0	0	0	112.8
98	R	22.1	Very low	24.6	Very low	244 Å²	244	149.5 Å²	149.5	92%	0.921	79%	0.788	S	S	*	*			trans	-167.3	170.9	178.6	-114.5	-169.1	-179.2	-165.2	3.3	107.3
99	P	30.7	Very low	24.4	Very low	98 Å²	98	151.2 Å²	151.2	64%	0.636	79%	0.787	S	S	*	*			cis	-136	168.8	-20.9	40	-24.5	0	0	0	114.6	I101	P99-I101 HydrophobicContact CB-CD1 4.47Å; P99-I101 HydrophobicContact CB-CG1 4.48Å; P99-I101 HydrophobicContact CG-CD1 4.44Å
100	S	21.9	Very low	24.4	Very low	111 Å²	111	154.3 Å²	154.3	78%	0.776	79%	0.794	S	S	*	*			trans	-167.3	118.2	141.2	-162.9	0	0	0	0	106.5
101	I	22.5	Very low	24.3	Very low	131 Å²	131	155.5 Å²	155.5	67%	0.672	79%	0.79	S	S	*	*			cis	67.8	132.4	48.4	-44	177.6	0	0	0	112.3	P99	P99-I101 HydrophobicContact CB-CD1 4.47Å; P99-I101 HydrophobicContact CB-CG1 4.48Å; P99-I101 HydrophobicContact CG-CD1 4.44Å
102	R	22	Very low	24.3	Very low	223 Å²	223	154.8 Å²	154.8	84%	0.842	79%	0.794	S	S	*	*			trans	81.5	128.4	178.6	-56	-159.8	-178.9	178.1	0.4	115
103	N	23.7	Very low	24.2	Very low	131 Å²	131	153.5 Å²	153.5	70%	0.701	79%	0.786	S	S	*	*			cis	-137.2	144	-2.1	-85.4	-31.1	0	0	0	112
104	A	22.4	Very low	24.1	Very low	102 Å²	102	150.4 Å²	150.4	84%	0.843	79%	0.788	S	S	*	*			trans	-112.1	123.1	150.2	0	0	0	0	0	107.3
105	T	23.2	Very low	24	Very low	123 Å²	123	149.4 Å²	149.4	76%	0.755	79%	0.785	S	S	*	*			trans	-140.3	118.7	175.7	37.1	0	0	0	0	109.1
106	N	22.4	Very low	23.4	Very low	139 Å²	139	148.4 Å²	148.4	74%	0.743	78%	0.781	S	S	*	*			trans	-80.4	176.5	176.7	-79	-39.4	0	0	0	112
107	F	21.3	Very low	23	Very low	190 Å²	190	149.3 Å²	149.3	83%	0.833	78%	0.78	S	S	*	*			trans	79.4	144.9	167	-51.6	-70	0	0	0	114.4
108	R	21.7	Very low	23.1	Very low	233 Å²	233	150.2 Å²	150.2	88%	0.879	78%	0.78	S	S	*	*			cis	-134.7	148.6	33.5	-72.8	176.5	167.5	171.9	-5.3	115.6
109	R	21.7	Very low	23.2	Very low	225 Å²	225	141.8 Å²	141.8	85%	0.849	77%	0.769	S	S	*	*			trans	-62.5	131.1	144	-81.4	178.3	169	161.7	-5.4	107.6
110	I	23.8	Very low	23	Very low	156 Å²	156	146 Å²	146	80%	0.8	78%	0.777	S	S	*	*			trans	-80	119.7	160.3	-62.6	176.7	0	0	0	106.9
111	I	22.8	Very low	23.1	Very low	139 Å²	139	148.3 Å²	148.3	71%	0.713	78%	0.776	S	S	*	*			trans	-114	128.3	158.1	-66.2	175.9	0	0	0	104.2
112	C	23.2	Very low	23.1	Very low	113 Å²	113	150.7 Å²	150.7	76%	0.764	78%	0.784	S	S	*	*			trans	-70.1	143.6	176.8	-63.4	0	0	0	0	110.1
113	I	22.6	Very low	23.9	Very low	153 Å²	153	144.9 Å²	144.9	79%	0.785	78%	0.775	S	S	*	*			trans	-83.5	133.5	178.6	-63	169.9	0	0	0	109.2	E115	I113-E115 HydrophobicContact CG2-CG 4.06Å
114	S	22.5	Very low	23.9	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	78%	0.782	S	S	*	*			trans	-121.7	137.6	141.4	57.6	0	0	0	0	107.1
115	E	23.3	Very low	24.1	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	78%	0.777	S	S	*	*			trans	-73.3	167.3	-176.4	-58.5	170.7	142.5	0	0	110.1	I113	I113-E115 HydrophobicContact CG2-CG 4.06Å
116	S	23.5	Very low	24	Very low	94 Å²	94	150.1 Å²	150.1	66%	0.657	78%	0.783	S	S	*	*			cis	-157.7	175.5	25.2	66	0	0	0	0	115.3
117	D	23.2	Very low	24.3	Very low	136 Å²	136	152.3 Å²	152.3	73%	0.727	79%	0.786	S	S	*	*			trans	64.9	96	147.9	-56.3	-34	0	0	0	125
118	S	25.6	Very low	24.4	Very low	122 Å²	122	152.7 Å²	152.7	85%	0.853	79%	0.791	S	S	*	*				89	148.1	116.7	81.6	0	0	0	0	122.5
119	G	23.9	Very low	24.4	Very low	67 Å²	67	147 Å²	147	69%	0.691	78%	0.782	S	S	*	*			trans	92.5	109.8	175.4	0	0	0	0	0	113.9
120	K	25.4	Very low	24.6	Very low	186 Å²	186	143.6 Å²	143.6	81%	0.809	78%	0.779	S	S	*	*				57.9	127	66.5	-65.8	-177.4	154.8	-130.5	0	113.1
121	E	24.8	Very low	24.6	Very low	161 Å²	161	145.7 Å²	145.7	75%	0.752	78%	0.783	S	S	*	*			cis	-150.5	168.1	11.4	-111.5	149.5	-148.1	0	0	111.8
122	E	21.6	Very low	25.1	Very low	181 Å²	181	144.9 Å²	144.9	85%	0.846	79%	0.785	S	S	*	*			trans	-102.7	174.7	173.5	-110.7	-165.2	-156.8	0	0	110.4
123	P	39.8	Very low	25.2	Very low	101 Å²	101	146.1 Å²	146.1	66%	0.656	78%	0.783	S	S	*	*			cis	-132.9	-164.4	-30.5	38.7	-21.5	0	0	0	111
124	V	23	Very low	25.3	Very low	138 Å²	138	147.2 Å²	147.2	84%	0.836	78%	0.783	S	S	*	*				-174.5	142.3	127.8	140.9	0	0	0	0	111.1
125	V	26.1	Very low	25.7	Very low	122 Å²	122	149.1 Å²	149.1	74%	0.739	78%	0.783	S	S	*	*			trans	-102.2	142.3	-178.5	175	0	0	0	0	111.3
126	K	22.7	Very low	25.9	Very low	206 Å²	206	152.2 Å²	152.2	90%	0.896	79%	0.787	S	S	*	*			trans	-146.5	136.1	148	-109.5	166.4	-173.2	179	0	111.4
127	K	27.7	Very low	26	Very low	184 Å²	184	155.9 Å²	155.9	80%	0.8	80%	0.798	S	S	*	*			trans	-96.4	149.2	167.8	-62	175.2	179.8	175.8	0	108.1
128	E	23.1	Very low	26.2	Very low	198 Å²	198	154.1 Å²	154.1	93%	0.925	80%	0.796	S	S	*	*			trans	-150.8	171.1	148.1	-136.3	156.4	-130.5	0	0	111.9
129	V	22.6	Very low	26.5	Very low	115 Å²	115	157.7 Å²	157.7	70%	0.697	80%	0.799	S	S	*	*			trans	-142.5	141.8	-151.5	172.5	0	0	0	0	111.8
130	L	25.3	Very low	26.8	Very low	152 Å²	152	160.4 Å²	160.4	80%	0.796	80%	0.803	S	S	*	*			trans	63	125.4	169.3	-107.4	76.6	0	0	0	118
131	K	23.6	Very low	27.4	Very low	200 Å²	200	160.8 Å²	160.8	87%	0.87	80%	0.804	S	S	*	*				-175.3	146.1	104.4	-97.6	155.8	-172.4	172.3	0	112
132	T	33.9	Very low	28	Very low	123 Å²	123	157 Å²	157	76%	0.755	79%	0.794	S	S	*	*			trans	-109.3	129.3	168.3	43.9	0	0	0	0	109.5
133	N	24.5	Very low	29.1	Very low	138 Å²	138	157.8 Å²	157.8	74%	0.738	80%	0.797	S	S	*	*				167.2	145.7	117.9	-93.3	-59.6	0	0	0	115.9
134	K	25.5	Very low	29.2	Very low	177 Å²	177	158.9 Å²	158.9	77%	0.77	79%	0.789	S	S	*	*			trans	67.8	103.2	147.5	-70.1	178.9	179.1	-178.6	0	122
135	L	31.7	Very low	30.7	Very low	154 Å²	154	155.5 Å²	155.5	81%	0.806	77%	0.77	S	S	*	*				62.4	108.2	117.5	-69.4	166.4	0	0	0	120.9
136	R	25.7	Very low	32.1	Very low	241 Å²	241	154.1 Å²	154.1	91%	0.909	76%	0.764	S	S	*	*				169.4	126.1	103.5	-95.4	178.6	172.6	171.7	-2.1	111.6
137	I	25.9	Very low	33.5	Very low	172 Å²	172	151.6 Å²	151.6	88%	0.882	76%	0.755	S	S	*	*			trans	-138.3	150.6	150.6	-64.9	-171.8	0	0	0	107.6
138	S	27.6	Very low	34.5	Very low	98 Å²	98	147 Å²	147	69%	0.685	74%	0.739	S	S	*	*			trans	-76.6	150.8	-170.6	42.2	0	0	0	0	115.3	T140	S138-T140 PolarHBondContact O-N 3.38Å
139	E	31.9	Very low	36	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	72%	0.719	S	S	*	*			trans	-76.7	96.7	164.1	-65.3	-179	159.8	0	0	110.4
140	T	30.6	Very low	37.8	Very low	125 Å²	125	143.7 Å²	143.7	77%	0.767	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-78.7	119.7	157.2	37.8	0	0	0	0	108.8	S138	S138-T140 PolarHBondContact O-N 3.38Å
141	K	37.3	Very low	38.9	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-64.1	136.3	176.3	-70.9	-177.9	177.6	179.6	0	110.1
142	P	37.1	Very low	40.4	Very low	83 Å²	83	136.1 Å²	136.1	54%	0.539	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-61.9	134.9	160.4	-17.3	30.9	0	0	0	109.6	Y144	P142-Y144 HydrophobicContact CB-CE2 4.19Å; P142-Y144 HydrophobicContact CG-CE2 4.38Å; P142-Y144 WeakPolarHBondContact O-CD2 3.45Å; P142-Y144 PolarHBondContact O-N 3.19Å
143	E	44.4	Very low	41.7	Very low	197 Å²	197	132.8 Å²	132.8	92%	0.921	67%	0.67	S	S	*	*			trans	-72	111.9	159.2	-72.1	-170.5	123.5	0	0	107.9
144	Y	42.9	Very low	43.1	Very low	124 Å²	124	134.6 Å²	134.6	49%	0.486	67%	0.666	S	S	.	*			trans	-80.6	142.8	177.5	-71.5	-80.2	0	0	0	110.5	P142 L148	P142-Y144 HydrophobicContact CB-CE2 4.19Å; P142-Y144 HydrophobicContact CG-CE2 4.38Å; P142-Y144 WeakPolarHBondContact O-CD2 3.45Å; P142-Y144 PolarHBondContact O-N 3.19Å; Y144-L148 HydrophobicContact CD1-CD1 4.25Å
145	P	54.5	Low	44.3	Very low	66 Å²	66	129.6 Å²	129.6	43%	0.429	65%	0.647	S	S	.	*			trans	-50	144.9	170.5	-27.9	34.7	0	0	0	111.9	E147 L148 L149	P145-E147 PolarHBondContact O-N 3.04Å; P145-E147 VanDerWaalsContact O-N 3.07Å; P145-L148 HydrophobicContact CG-CD1 4.45Å; P145-L148 WeakPolarHBondContact O-CB 3.1Å; P145-L148 PolarHBondContact O-N 3.44Å; P145-L149 PolarHBondContact O-N 3.17Å; P145-L149 VanDerWaalsContact O-N 3.15Å
146	P	54.6	Low	45.3	Very low	94 Å²	94	128.1 Å²	128.1	61%	0.61	64%	0.636	S	S	*	*	H	α-helix	trans	-58.9	-27.5	-176.6	23	-33.7	0	0	0	112.9	L149 Q150	P146-L149 PolarHBondContact O-N 3.41Å; P146-Q150 WeakPolarHBondContact O-CG 3.48Å; P146-Q150 PolarHBondContact O-N 2.84Å
147	E	52.6	Low	46.7	Very low	152 Å²	152	123.4 Å²	123.4	71%	0.71	63%	0.625	S	S	*	*	H	α-helix	trans	-64.9	-39.5	174.1	-63.8	159.8	170.9	0	0	112.3	P145 Q150 L151	P145-E147 PolarHBondContact O-N 3.04Å; P145-E147 VanDerWaalsContact O-N 3.07Å; E147-Q150 PolarHBondContact O-N 3.42Å; E147-L151 WeakPolarHBondContact O-CB 3.12Å; E147-L151 PolarHBondContact O-N 3.11Å
148	L	49.3	Very low	47.7	Very low	87 Å²	87	120.6 Å²	120.6	46%	0.455	61%	0.611	S	S	.	*	H	α-helix	trans	-72	-36.8	175.2	-96.5	163.9	0	0	0	111.6	Y144 P145 L151 E152	Y144-L148 HydrophobicContact CD1-CD1 4.25Å; P145-L148 HydrophobicContact CG-CD1 4.45Å; P145-L148 WeakPolarHBondContact O-CB 3.1Å; P145-L148 PolarHBondContact O-N 3.44Å; L148-L151 PolarHBondContact O-N 3.25Å; L148-E152 WeakPolarHBondContact O-CB 3.47Å; L148-E152 PolarHBondContact O-N 2.79Å
149	L	54.7	Low	48.5	Very low	98 Å²	98	123.4 Å²	123.4	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-63.5	-40.1	171.9	-74.8	165.9	0	0	0	112	P145 P146 A153	P145-L149 PolarHBondContact O-N 3.17Å; P145-L149 VanDerWaalsContact O-N 3.15Å; P146-L149 PolarHBondContact O-N 3.41Å; L149-A153 VanDerWaalsContact O-CB 3.32Å; L149-A153 WeakPolarHBondContact O-CB 3.39Å; L149-A153 PolarHBondContact O-N 3.48Å
150	Q	59	Low	49.3	Very low	146 Å²	146	117.6 Å²	117.6	68%	0.682	59%	0.592	S	S	*	*	H	α-helix	trans	-64.7	-42.5	171.6	-74.4	-175.4	12.8	0	0	112.1	P146 E147 E152 A153 R154	P146-Q150 WeakPolarHBondContact O-CG 3.48Å; P146-Q150 PolarHBondContact O-N 2.84Å; E147-Q150 PolarHBondContact O-N 3.42Å; Q150-E152 VanDerWaalsContact C-N 3.34Å; Q150-E152 PolarHBondContact O-N 3.39Å; Q150-A153 PolarHBondContact O-N 2.93Å; Q150-R154 VanDerWaalsContact O-CB 3.3Å; Q150-R154 WeakPolarHBondContact O-CB 3.47Å; Q150-R154 PolarHBondContact O-N 2.85Å
151	L	49.5	Very low	49.9	Very low	101 Å²	101	115 Å²	115	53%	0.529	59%	0.591	S	S	.	*	H	α-helix	trans	-63.4	-41.3	177.7	-151.2	85.5	0	0	0	111.6	E147 L148 L155	E147-L151 WeakPolarHBondContact O-CB 3.12Å; E147-L151 PolarHBondContact O-N 3.11Å; L148-L151 PolarHBondContact O-N 3.25Å; L151-L155 WeakPolarHBondContact O-CB 3.49Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 3.14Å
152	E	55	Low	50.2	Low	92 Å²	92	116.4 Å²	116.4	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-40.1	179.1	-173.7	158.7	-132.9	0	0	112.2	L148 Q150 R154 L155 Q156	L148-E152 WeakPolarHBondContact O-CB 3.47Å; L148-E152 PolarHBondContact O-N 2.79Å; Q150-E152 VanDerWaalsContact C-N 3.34Å; Q150-E152 PolarHBondContact O-N 3.39Å; E152-R154 PolarHBondContact O-N 2.95Å; E152-L155 CarbonylContact O-C 3.56Å; E152-L155 PolarHBondContact O-N 3.41Å; E152-Q156 WeakPolarHBondContact O-CG 3.34Å; E152-Q156 PolarHBondContact O-N 3.46Å
153	A	62.1	Low	50.4	Low	53 Å²	53	120.8 Å²	120.8	44%	0.438	60%	0.601	S	S	.	*	H	α-helix	trans	-58.6	-47.5	171.3	0	0	0	0	0	111.5	L149 Q150 L155 Q156 E157	L149-A153 VanDerWaalsContact O-CB 3.32Å; L149-A153 WeakPolarHBondContact O-CB 3.39Å; L149-A153 PolarHBondContact O-N 3.48Å; Q150-A153 PolarHBondContact O-N 2.93Å; A153-L155 VanDerWaalsContact C-N 3.3Å; A153-L155 PolarHBondContact O-N 3.28Å; A153-Q156 CarbonylContact O-C 3.6Å; A153-Q156 WeakPolarHBondContact O-CA 3.49Å; A153-Q156 WeakPolarHBondContact O-CB 3.18Å; A153-Q156 PolarHBondContact O-N 3.32Å; A153-E157 PolarHBondContact O-N 3.05Å
154	R	52.9	Low	50.3	Low	177 Å²	177	118.2 Å²	118.2	67%	0.668	59%	0.594	S	S	*	*	H	α-helix	trans	-64.2	-33.7	177.7	-156.9	173.5	-168.7	178.8	2.8	112.3	Q150 E152 L158	Q150-R154 VanDerWaalsContact O-CB 3.3Å; Q150-R154 WeakPolarHBondContact O-CB 3.47Å; Q150-R154 PolarHBondContact O-N 2.85Å; E152-R154 PolarHBondContact O-N 2.95Å; R154-L158 VanDerWaalsContact O-CG 3.29Å; R154-L158 WeakPolarHBondContact O-CG 3.47Å; R154-L158 PolarHBondContact O-N 2.75Å; R154-L158 VanDerWaalsContact O-N 3.16Å
155	L	50.5	Low	49.9	Very low	72 Å²	72	122.4 Å²	122.4	38%	0.377	61%	0.614	S	S	.	*	H	α-helix	trans	-71.5	-31.8	170.3	-77.5	168.1	0	0	0	112.8	L151 E152 A153 R159	L151-L155 WeakPolarHBondContact O-CB 3.49Å; L151-L155 VanDerWaalsContact O-CG 3.31Å; L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 3.14Å; E152-L155 CarbonylContact O-C 3.56Å; E152-L155 PolarHBondContact O-N 3.41Å; A153-L155 VanDerWaalsContact C-N 3.3Å; A153-L155 PolarHBondContact O-N 3.28Å; L155-R159 WeakPolarHBondContact O-CB 3.48Å; L155-R159 VanDerWaalsContact O-CD 3.28Å; L155-R159 WeakPolarHBondContact O-CD 3.4Å; L155-R159 WeakPolarHBondContact O-CG 3.48Å; L155-R159 PolarHBondContact O-N 2.93Å
156	Q	54	Low	49.6	Very low	122 Å²	122	128.1 Å²	128.1	57%	0.57	64%	0.635	S	S	*	*	H	α-helix	trans	-69.3	-41.7	172.6	-74	-171.7	24.2	0	0	111.7	E152 A153 L158 R159 A160	E152-Q156 WeakPolarHBondContact O-CG 3.34Å; E152-Q156 PolarHBondContact O-N 3.46Å; A153-Q156 CarbonylContact O-C 3.6Å; A153-Q156 WeakPolarHBondContact O-CA 3.49Å; A153-Q156 WeakPolarHBondContact O-CB 3.18Å; A153-Q156 PolarHBondContact O-N 3.32Å; Q156-L158 PolarHBondContact O-N 3.11Å; Q156-R159 CarbonylContact O-C 3.6Å; Q156-R159 PolarHBondContact O-N 3.02Å; Q156-R159 VanDerWaalsContact O-N 3.16Å; Q156-A160 WeakPolarHBondContact O-CB 3.24Å; Q156-A160 PolarHBondContact O-N 3.06Å
157	E	53.3	Low	48.5	Very low	143 Å²	143	126.5 Å²	126.5	67%	0.668	64%	0.636	S	S	*	*	H	α-helix	trans	-57.5	-48.9	172	-68.5	-177.6	141	0	0	111.6	A153 R159 A160 G161	A153-E157 PolarHBondContact O-N 3.05Å; E157-R159 PolarHBondContact O-N 2.8Å; E157-A160 PolarHBondContact O-N 3.42Å; E157-G161 PolarHBondContact O-N 3.04Å
158	L	47.1	Very low	47.6	Very low	112 Å²	112	130.8 Å²	130.8	59%	0.586	65%	0.646	S	S	*	*	H	α-helix	trans	-64.5	-24.7	177.4	-71.6	169.6	0	0	0	113.7	R154 Q156	R154-L158 VanDerWaalsContact O-CG 3.29Å; R154-L158 WeakPolarHBondContact O-CG 3.47Å; R154-L158 PolarHBondContact O-N 2.75Å; R154-L158 VanDerWaalsContact O-N 3.16Å; Q156-L158 PolarHBondContact O-N 3.11Å
159	R	45.1	Very low	46.8	Very low	158 Å²	158	134 Å²	134	60%	0.596	66%	0.661	S	S	*	*	H	α-helix	trans	-84.1	-38	173.9	-74.2	165.2	-179.1	168.5	0.5	112	L155 Q156 E157 R162	L155-R159 WeakPolarHBondContact O-CB 3.48Å; L155-R159 VanDerWaalsContact O-CD 3.28Å; L155-R159 WeakPolarHBondContact O-CD 3.4Å; L155-R159 WeakPolarHBondContact O-CG 3.48Å; L155-R159 PolarHBondContact O-N 2.93Å; Q156-R159 CarbonylContact O-C 3.6Å; Q156-R159 PolarHBondContact O-N 3.02Å; Q156-R159 VanDerWaalsContact O-N 3.16Å; E157-R159 PolarHBondContact O-N 2.8Å; R159-R162 PolarHBondContact O-N 3.31Å; R159-R162 VanDerWaalsContact O-N 3.17Å
160	A	47.8	Very low	45.8	Very low	74 Å²	74	134.6 Å²	134.6	61%	0.612	67%	0.666	S	S	*	*	H	α-helix	trans	-62.6	-43.9	174.8	0	0	0	0	0	111.1	Q156 E157 R162 K163	Q156-A160 WeakPolarHBondContact O-CB 3.24Å; Q156-A160 PolarHBondContact O-N 3.06Å; E157-A160 PolarHBondContact O-N 3.42Å; A160-R162 PolarHBondContact O-N 2.84Å; A160-K163 PolarHBondContact O-N 3.39Å
161	G	43.3	Very low	44.6	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-2.4	174.1	0	0	0	0	0	115.7	E157	E157-G161 PolarHBondContact O-N 3.04Å
162	R	43.7	Very low	43.9	Very low	221 Å²	221	142.1 Å²	142.1	83%	0.834	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	12	-177.1	-72.9	-172	175.3	-164.9	0.8	115.2	R159 A160	R159-R162 PolarHBondContact O-N 3.31Å; R159-R162 VanDerWaalsContact O-N 3.17Å; A160-R162 PolarHBondContact O-N 2.84Å
163	K	42.7	Very low	42.6	Very low	175 Å²	175	146.7 Å²	146.7	76%	0.761	70%	0.704	S	S	*	*	S	Bend	trans	-130.3	149.2	169	-71	-171.4	176.7	-178.9	0	112.2	A160	A160-K163 PolarHBondContact O-N 3.39Å
164	N	41.1	Very low	41.1	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	72%	0.721	S	S	*	*			trans	64.3	61.7	173.1	-61.1	-4.6	0	0	0	117.6
165	K	35.4	Very low	39.9	Very low	212 Å²	212	145.9 Å²	145.9	92%	0.922	72%	0.722	S	S	*	*			trans	-105.4	82	131.1	-78.3	-171.5	177.8	178.6	0	109.9	G167	K165-G167 PolarHBondContact O-N 3.41Å
166	Q	48.4	Very low	38.9	Very low	185 Å²	185	151.1 Å²	151.1	86%	0.864	74%	0.742	S	S	*	*			trans	-70.4	71.4	160.2	-80.3	-172.8	-22.4	0	0	109.1	R168	Q166-R168 PolarHBondContact O-N 3.06Å; Q166-R168 VanDerWaalsContact O-N 3.15Å
167	G	31	Very low	37.9	Very low	61 Å²	61	151.5 Å²	151.5	63%	0.629	76%	0.755	S	S	*	*			trans	-69.4	107.4	173.3	0	0	0	0	0	110	K165 I169	K165-G167 PolarHBondContact O-N 3.41Å; G167-I169 PolarHBondContact O-N 3.1Å
168	R	33.2	Very low	36.7	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	77%	0.766	S	S	*	*			trans	-49.7	127.4	155.1	-80.6	179.9	167.9	177	-4.2	107.2	Q166 N170	Q166-R168 PolarHBondContact O-N 3.06Å; Q166-R168 VanDerWaalsContact O-N 3.15Å; R168-N170 PolarHBondContact O-N 3.02Å
169	I	32.3	Very low	35.9	Very low	154 Å²	154	148.5 Å²	148.5	79%	0.79	77%	0.766	S	S	*	*			trans	-65.2	98.3	176.2	-60.1	177.4	0	0	0	108	G167 R171	G167-I169 PolarHBondContact O-N 3.1Å; I169-R171 HydrophobicContact CG2-CG 4.37Å; I169-R171 PolarHBondContact O-N 3.5Å
170	N	34.4	Very low	35.5	Very low	112 Å²	112	147.8 Å²	147.8	60%	0.599	78%	0.779	S	S	*	*			trans	-78.2	88.5	-177	-173.7	6.9	0	0	0	109.8	R168 K172	R168-N170 PolarHBondContact O-N 3.02Å; N170-K172 PolarHBondContact O-N 3.46Å; N170-K172 WeakPolarHBondContact OD1-CB 3.29Å; N170-K172 PolarHBondContact OD1-N 3.11Å
171	R	34.3	Very low	34.6	Very low	226 Å²	226	150 Å²	150	85%	0.853	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	11.6	179.9	-70.7	-177.5	167.5	178.9	-5.3	115.2	I169	I169-R171 HydrophobicContact CG2-CG 4.37Å; I169-R171 PolarHBondContact O-N 3.5Å
172	K	33.6	Very low	34	Very low	179 Å²	179	151.9 Å²	151.9	78%	0.778	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-5.7	-178.4	-68.7	-164	171.1	-169.3	0	115.8	N170	N170-K172 PolarHBondContact O-N 3.46Å; N170-K172 WeakPolarHBondContact OD1-CB 3.29Å; N170-K172 PolarHBondContact OD1-N 3.11Å
173	F	28.5	Very low	33.5	Very low	187 Å²	187	144 Å²	144	82%	0.82	78%	0.775	S	S	*	*			trans	-124.5	75.2	171.4	-83.8	-85.6	0	0	0	111.4
174	V	31.1	Very low	33.1	Very low	130 Å²	130	145.3 Å²	145.3	79%	0.788	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70	119.5	147.6	177.2	0	0	0	0	106	K176	V174-K176 PolarHBondContact O-N 3.29Å
175	A	26.8	Very low	32.5	Very low	84 Å²	84	144.1 Å²	144.1	69%	0.694	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63.9	132.2	170.9	0	0	0	0	0	108.8
176	K	30.7	Very low	32.2	Very low	182 Å²	182	139.9 Å²	139.9	79%	0.791	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-58.8	145.8	167.3	-78.9	-173	173.3	-175.4	0	108.8	V174 C178	V174-K176 PolarHBondContact O-N 3.29Å; K176-C178 PolarHBondContact O-N 3.29Å
177	P	31.7	Very low	31.3	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	77%	0.771	S	S	*	*			trans	-60.9	106.1	173	-21.5	33	0	0	0	110.8	G179	P177-G179 PolarHBondContact O-N 2.99Å
178	C	28.7	Very low	31.1	Very low	134 Å²	134	147 Å²	147	91%	0.905	78%	0.783	S	S	*	*			trans	-89.9	82.4	172.6	-71.8	0	0	0	0	109	K176	K176-C178 PolarHBondContact O-N 3.29Å
179	G	30.5	Very low	31	Very low	57 Å²	57	140.5 Å²	140.5	59%	0.588	77%	0.772	S	S	*	*			trans	169.4	89.1	179	0	0	0	0	0	112.2	P177 V181	P177-G179 PolarHBondContact O-N 2.99Å; G179-V181 PolarHBondContact O-N 3.25Å
180	V	35.5	Very low	30.8	Very low	144 Å²	144	143.1 Å²	143.1	87%	0.873	78%	0.777	S	S	*	*			trans	-78.4	98.7	162.2	179.3	0	0	0	0	106.7	S182	V180-S182 PolarHBondContact O-N 3.24Å; V180-S182 VanDerWaalsContact O-N 3.11Å
181	V	30.3	Very low	30.9	Very low	119 Å²	119	141.2 Å²	141.2	72%	0.721	77%	0.767	S	S	*	*			trans	-79.8	90.1	174.1	-177.8	0	0	0	0	107.9	G179 G183	G179-V181 PolarHBondContact O-N 3.25Å; V181-G183 PolarHBondContact O-N 3.21Å
182	S	31.1	Very low	30.9	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	77%	0.766	S	S	*	*			trans	-76.2	114.3	173.4	54.4	0	0	0	0	110.5	V180	V180-S182 PolarHBondContact O-N 3.24Å; V180-S182 VanDerWaalsContact O-N 3.11Å
183	G	31.9	Very low	30.9	Very low	56 Å²	56	139.6 Å²	139.6	58%	0.577	77%	0.772	S	S	*	*			trans	-174.6	144.9	172.6	0	0	0	0	0	110.5	V181 T185	V181-G183 PolarHBondContact O-N 3.21Å; G183-T185 PolarHBondContact O-N 3.23Å
184	E	34.7	Very low	31	Very low	202 Å²	202	136.6 Å²	136.6	94%	0.944	76%	0.762	S	S	*	*	S	Bend	trans	-80.2	23.8	-172.3	-58.3	-176.9	141.6	0	0	113.4	P186	E184-P186 WeakPolarHBondContact O-CD 3.18Å
185	T	28.3	Very low	31	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.724	76%	0.759	S	S	*	*			trans	-95	118	-176.5	-41.3	0	0	0	0	110.3	G183 Q187	G183-T185 PolarHBondContact O-N 3.23Å; T185-Q187 PolarHBondContact O-N 2.92Å; T185-Q187 VanDerWaalsContact O-N 3.1Å
186	P	29.6	Very low	31.3	Very low	124 Å²	124	141 Å²	141	81%	0.805	75%	0.749	S	S	*	*			trans	-60.3	115.4	178.2	-25.2	35.3	0	0	0	112	E184 R188	E184-P186 WeakPolarHBondContact O-CD 3.18Å; P186-R188 PolarHBondContact O-N 3.33Å
187	Q	29.5	Very low	31.6	Very low	164 Å²	164	139.3 Å²	139.3	77%	0.766	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-70.1	130.4	175.2	-67.3	-174.4	-3.2	0	0	110.1	T185 P189	T185-Q187 PolarHBondContact O-N 2.92Å; T185-Q187 VanDerWaalsContact O-N 3.1Å; Q187-P189 WeakPolarHBondContact O-CD 3.46Å
188	R	27.2	Very low	31.9	Very low	231 Å²	231	135.4 Å²	135.4	87%	0.872	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-65.6	129.4	169.6	-80.7	-174.9	171.9	-175	-3.2	109.9	P186	P186-R188 PolarHBondContact O-N 3.33Å
189	P	29.6	Very low	32.4	Very low	105 Å²	105	133.3 Å²	133.3	68%	0.682	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-60.3	152.9	161.5	-21.2	34	0	0	0	111.4	Q187	Q187-P189 WeakPolarHBondContact O-CD 3.46Å
190	F	29	Very low	32.8	Very low	208 Å²	208	139.4 Å²	139.4	91%	0.912	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-59.9	134.1	172.7	-73.3	-106.7	0	0	0	110.3
191	L	36.5	Very low	33.1	Very low	73 Å²	73	137.4 Å²	137.4	38%	0.382	69%	0.693	S	S	.	*			trans	-131	-21.7	-169.6	-99.6	160.8	0	0	0	116.1	E193 M194 Y195	L191-E193 VanDerWaalsContact C-N 3.31Å; L191-E193 PolarHBondContact O-N 3.3Å; L191-M194 HydrophobicContact CD2-CE 4.04Å; L191-M194 PolarHBondContact O-N 3.35Å; L191-M194 VanDerWaalsContact O-N 3.14Å; L191-Y195 HydrophobicContact CB-CE2 4.13Å; L191-Y195 HydrophobicContact CD2-CE2 3.8Å; L191-Y195 HydrophobicContact CG-CE2 4.48Å; L191-Y195 VanDerWaalsContact O-CD2 3.28Å; L191-Y195 WeakPolarHBondContact O-CD2 3.3Å
192	E	33.1	Very low	33.5	Very low	176 Å²	176	134.2 Å²	134.2	82%	0.822	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-29.3	-175.8	-69.7	-157.5	111.9	0	0	114.1	M194	E192-M194 VanDerWaalsContact C-N 3.28Å; E192-M194 PolarHBondContact O-N 2.72Å
193	E	35	Very low	33.7	Very low	195 Å²	195	129.8 Å²	129.8	91%	0.911	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-12.6	177.3	-62.2	-167.9	148.6	0	0	113.3	L191	L191-E193 VanDerWaalsContact C-N 3.31Å; L191-E193 PolarHBondContact O-N 3.3Å
194	M	30.5	Very low	34.2	Very low	123 Å²	123	130.8 Å²	130.8	61%	0.606	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-17.7	177.6	-61.1	-142	-59.2	0	0	114	L191 E192	L191-M194 HydrophobicContact CD2-CE 4.04Å; L191-M194 PolarHBondContact O-N 3.35Å; L191-M194 VanDerWaalsContact O-N 3.14Å; E192-M194 VanDerWaalsContact C-N 3.28Å; E192-M194 PolarHBondContact O-N 2.72Å
195	Y	31.3	Very low	34.2	Very low	185 Å²	185	123.7 Å²	123.7	73%	0.725	62%	0.617	S	S	*	*	S	Bend	trans	-84.5	-4.7	-176	-77.7	-62.3	0	0	0	115.3	L191 F197	L191-Y195 HydrophobicContact CB-CE2 4.13Å; L191-Y195 HydrophobicContact CD2-CE2 3.8Å; L191-Y195 HydrophobicContact CG-CE2 4.48Å; L191-Y195 VanDerWaalsContact O-CD2 3.28Å; L191-Y195 WeakPolarHBondContact O-CD2 3.3Å; Y195-F197 PolarHBondContact O-N 2.96Å
196	Y	33.6	Very low	34.7	Very low	122 Å²	122	120.4 Å²	120.4	48%	0.478	60%	0.599	S	S	.	*			trans	-98.7	61.8	177.6	-150.9	-86.1	0	0	0	112.3	N198 T202 K264	Y196-N198 PolarHBondContact O-N 3.28Å; Y196-T202 WeakPolarHBondContact O-CG2 3.18Å; Y196-K264 PolarHBondContact OH-NZ 3.06Å
197	F	36.1	Very low	35.2	Very low	147 Å²	147	118 Å²	118	65%	0.645	58%	0.576	S	S	*	*			trans	-60.1	115.5	176.3	178	-105.7	0	0	0	111.7	Y195 P199	Y195-F197 PolarHBondContact O-N 2.96Å; F197-P199 HydrophobicContact CE1-CG 3.79Å; F197-P199 HydrophobicContact CE2-CG 4.19Å; F197-P199 HydrophobicContact CZ-CG 3.58Å
198	N	38.3	Very low	35.7	Very low	47 Å²	47	113.1 Å²	113.1	25%	0.251	56%	0.555	S	S	.	*			trans	-141.9	110.2	164.4	177.8	-1.1	0	0	0	108.7	Y196 Q200 E201 T202	Y196-N198 PolarHBondContact O-N 3.28Å; N198-Q200 PolarHBondContact O-N 2.66Å; N198-Q200 PolarHBondContact OD1-N 2.95Å; N198-E201 HydrophobicContact CB-CB 4.15Å; N198-E201 VanDerWaalsContact ND2-CG 3.33Å; N198-E201 WeakPolarHBondContact ND2-CG 3.23Å; N198-E201 PolarHBondContact ND2-OE2 3.32Å; N198-E201 PolarHBondContact O-N 3.1Å; N198-T202 PolarHBondContact N-OG1 2.86Å; N198-T202 PolarHBondContact O-N 3.03Å; N198-T202 PolarHBondContact O-OG1 3.38Å; N198-T202 VanDerWaalsContact O-OG1 3.08Å
199	P	37.8	Very low	36.2	Very low	91 Å²	91	108.4 Å²	108.4	59%	0.591	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-17.4	179.8	-29.1	36.3	0	0	0	115.8	F197	F197-P199 HydrophobicContact CE1-CG 3.79Å; F197-P199 HydrophobicContact CE2-CG 4.19Å; F197-P199 HydrophobicContact CZ-CG 3.58Å
200	Q	40.8	Very low	36.9	Very low	185 Å²	185	108.3 Å²	108.3	86%	0.864	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-4.1	176.4	-56.9	-161.1	9.6	0	0	114.4	N198	N198-Q200 PolarHBondContact O-N 2.66Å; N198-Q200 PolarHBondContact OD1-N 2.95Å
201	E	40.3	Very low	37.4	Very low	101 Å²	101	99.6 Å²	99.6	47%	0.472	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-24.3	179.4	-64.7	-174.8	122.3	0	0	114.3	N198 K261	N198-E201 HydrophobicContact CB-CB 4.15Å; N198-E201 VanDerWaalsContact ND2-CG 3.33Å; N198-E201 WeakPolarHBondContact ND2-CG 3.23Å; N198-E201 PolarHBondContact ND2-OE2 3.32Å; N198-E201 PolarHBondContact O-N 3.1Å; E201-K261 IonicContact OE1-NZ 2.65Å; E201-K261 PolarHBondContact OE1-NZ 3.02Å; E201-K261 IonicContact OE2-NZ 3.97Å; E201-K261 PolarHBondContact OE2-NZ 2.82Å
202	T	39.3	Very low	37.6	Very low	52 Å²	52	100 Å²	100	32%	0.319	50%	0.5	S	S	.	.			trans	-128.9	59.3	-169.4	62.3	0	0	0	0	113.9	Y196 N198	Y196-T202 WeakPolarHBondContact O-CG2 3.18Å; N198-T202 PolarHBondContact N-OG1 2.86Å; N198-T202 PolarHBondContact O-N 3.03Å; N198-T202 PolarHBondContact O-OG1 3.38Å; N198-T202 VanDerWaalsContact O-OG1 3.08Å
203	G	36	Very low	38.1	Very low	20 Å²	20	98.3 Å²	98.3	21%	0.206	49%	0.49	C	S	.	.	H	α-helix	trans	-68.9	-39.4	-176.4	0	0	0	0	0	115.6	A205 E207	G203-A205 PolarHBondContact O-N 3.26Å; G203-E207 WeakPolarHBondContact O-CB 3.49Å; G203-E207 WeakPolarHBondContact O-CG 3.41Å; G203-E207 PolarHBondContact O-N 2.9Å
204	T	42.2	Very low	38.6	Very low	77 Å²	77	90.9 Å²	90.9	47%	0.472	46%	0.458	S	S	.	.	H	α-helix	trans	-60.2	-42.9	-162.3	36.8	0	0	0	0	116.6	I208	T204-I208 VanDerWaalsContact O-CB 3.29Å; T204-I208 WeakPolarHBondContact O-CB 3.44Å; T204-I208 VanDerWaalsContact O-CD1 3.31Å; T204-I208 WeakPolarHBondContact O-CD1 3.28Å; T204-I208 WeakPolarHBondContact O-CG1 3.45Å; T204-I208 PolarHBondContact O-N 2.87Å
205	A	35.3	Very low	39.4	Very low	54 Å²	54	88 Å²	88	45%	0.446	46%	0.455	S	S	.	.	H	α-helix	trans	-70.6	-52.8	-172	0	0	0	0	0	111.4	G203 I208 F209	G203-A205 PolarHBondContact O-N 3.26Å; A205-I208 PolarHBondContact O-N 3.49Å; A205-F209 PolarHBondContact O-N 2.98Å
206	S	37.4	Very low	40.1	Very low	49 Å²	49	87.2 Å²	87.2	34%	0.343	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-47.7	179	-54.5	0	0	0	0	112.1	I208 F209 D210	S206-I208 PolarHBondContact O-N 2.8Å; S206-I208 VanDerWaalsContact O-N 3.14Å; S206-F209 PolarHBondContact O-N 3.48Å; S206-D210 WeakPolarHBondContact O-CB 3.14Å; S206-D210 PolarHBondContact O-N 2.8Å
207	E	41.3	Very low	40.8	Very low	72 Å²	72	88.7 Å²	88.7	34%	0.336	47%	0.471	S	S	.	.	H	α-helix	trans	-57.3	-34.3	178.3	-69.2	167.2	-176.9	0	0	112.1	G203 M211 R243	G203-E207 WeakPolarHBondContact O-CB 3.49Å; G203-E207 WeakPolarHBondContact O-CG 3.41Å; G203-E207 PolarHBondContact O-N 2.9Å; E207-M211 WeakPolarHBondContact O-CB 3.36Å; E207-M211 WeakPolarHBondContact O-CE 3.25Å; E207-M211 VanDerWaalsContact O-CG 3.25Å; E207-M211 WeakPolarHBondContact O-CG 3.41Å; E207-M211 PolarHBondContact O-N 3.22Å; E207-M211 VanDerWaalsContact O-N 3.14Å; E207-R243 IonicContact OE2-CZ 3.21Å; E207-R243 IonicContact OE2-NE 3.71Å; E207-R243 IonicContact OE2-NH2 3.16Å; E207-R243 PolarHBondContact OE2-NH2 3.32Å
208	I	38.3	Very low	41.4	Very low	62 Å²	62	84.6 Å²	84.6	32%	0.318	46%	0.458	S	S	.	.	H	α-helix	trans	-75.5	-39.1	174.9	-69.7	171.8	0	0	0	111.6	T204 A205 S206 M211 L212 F236	T204-I208 VanDerWaalsContact O-CB 3.29Å; T204-I208 WeakPolarHBondContact O-CB 3.44Å; T204-I208 VanDerWaalsContact O-CD1 3.31Å; T204-I208 WeakPolarHBondContact O-CD1 3.28Å; T204-I208 WeakPolarHBondContact O-CG1 3.45Å; T204-I208 PolarHBondContact O-N 2.87Å; A205-I208 PolarHBondContact O-N 3.49Å; S206-I208 PolarHBondContact O-N 2.8Å; S206-I208 VanDerWaalsContact O-N 3.14Å; I208-M211 HydrophobicContact CG1-CE 3.98Å; I208-M211 PolarHBondContact O-N 3.34Å; I208-L212 HydrophobicContact CG2-CD1 3.79Å; I208-L212 HydrophobicContact CG2-CG 4.36Å; I208-L212 WeakPolarHBondContact O-CB 3.4Å; I208-L212 VanDerWaalsContact O-CG 3.26Å; I208-L212 WeakPolarHBondContact O-CG 3.19Å; I208-L212 PolarHBondContact O-N 2.82Å; I208-F236 HydrophobicContact CD1-CE1 3.97Å; I208-F236 HydrophobicContact CD1-CZ 4.29Å; I208-F236 HydrophobicContact CG1-CE1 3.82Å; I208-F236 HydrophobicContact CG1-CZ 4.09Å
209	F	39.5	Very low	41.6	Very low	132 Å²	132	88 Å²	88	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-65.1	-43.1	177.4	-142.4	-88.8	0	0	0	111.5	A205 S206 M211 L212 F213	A205-F209 PolarHBondContact O-N 2.98Å; S206-F209 PolarHBondContact O-N 3.48Å; F209-M211 VanDerWaalsContact C-N 3.34Å; F209-M211 PolarHBondContact O-N 3.13Å; F209-L212 PolarHBondContact O-N 3.46Å; F209-F213 AromaticContact CD1-CD2 3.78Å; F209-F213 HydrophobicContact CD1-CD2 3.78Å; F209-F213 HydrophobicContact CD1-CE2 4.42Å; F209-F213 AromaticContact CE1-CD2 3.64Å; F209-F213 HydrophobicContact CE1-CD2 3.64Å; F209-F213 HydrophobicContact CE1-CE2 4.03Å; F209-F213 HydrophobicContact CE2-CE2 4.33Å; F209-F213 HydrophobicContact CG-CD2 4.33Å; F209-F213 HydrophobicContact CZ-CD2 4.08Å; F209-F213 AromaticContact CZ-CE2 3.98Å; F209-F213 HydrophobicContact CZ-CE2 3.98Å; F209-F213 PolarHBondContact O-N 3.3Å
210	D	43.6	Very low	41.9	Very low	104 Å²	104	91.3 Å²	91.3	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-70.6	-27.1	178	-58.7	-29.7	0	0	0	112.2	S206 P214	S206-D210 WeakPolarHBondContact O-CB 3.14Å; S206-D210 PolarHBondContact O-N 2.8Å; D210-P214 WeakPolarHBondContact O-CA 3.32Å; D210-P214 WeakPolarHBondContact O-CG 3.33Å
211	M	40.4	Very low	42	Very low	24 Å²	24	86 Å²	86	12%	0.118	47%	0.47	C	S	.	.	H	α-helix	trans	-73.6	-40.5	169	-80.8	-172.3	-63	0	0	112.6	E207 I208 F209 P214 W224 Q235 F236 I239	E207-M211 WeakPolarHBondContact O-CB 3.36Å; E207-M211 WeakPolarHBondContact O-CE 3.25Å; E207-M211 VanDerWaalsContact O-CG 3.25Å; E207-M211 WeakPolarHBondContact O-CG 3.41Å; E207-M211 PolarHBondContact O-N 3.22Å; E207-M211 VanDerWaalsContact O-N 3.14Å; I208-M211 HydrophobicContact CG1-CE 3.98Å; I208-M211 PolarHBondContact O-N 3.34Å; F209-M211 VanDerWaalsContact C-N 3.34Å; F209-M211 PolarHBondContact O-N 3.13Å; M211-P214 WeakPolarHBondContact O-CD 3.14Å; M211-P214 WeakPolarHBondContact O-CG 3.45Å; M211-W224 WeakPolarHBondContact O-CZ2 3.34Å; M211-W224 PolarHBondContact O-NE1 2.96Å; M211-Q235 HydrophobicContact SD-CB 3.66Å; M211-Q235 HydrophobicContact SD-CG 4.48Å; M211-F236 HydrophobicContact CE-CD1 4.21Å; M211-F236 HydrophobicContact CE-CE1 3.74Å; M211-F236 HydrophobicContact CE-CZ 4.02Å; M211-I239 HydrophobicContact CE-CD1 3.64Å; M211-I239 HydrophobicContact SD-CD1 3.8Å
212	L	38.9	Very low	42.3	Very low	82 Å²	82	91.7 Å²	91.7	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-73.5	-33	179.7	-71.3	170	0	0	0	112.4	I208 F209 W224	I208-L212 HydrophobicContact CG2-CD1 3.79Å; I208-L212 HydrophobicContact CG2-CG 4.36Å; I208-L212 WeakPolarHBondContact O-CB 3.4Å; I208-L212 VanDerWaalsContact O-CG 3.26Å; I208-L212 WeakPolarHBondContact O-CG 3.19Å; I208-L212 PolarHBondContact O-N 2.82Å; F209-L212 PolarHBondContact O-N 3.46Å; L212-W224 HydrophobicContact CD2-CH2 4.06Å; L212-W224 HydrophobicContact CD2-CZ2 4.19Å; L212-W224 PolarHBondContact O-NE1 3.17Å
213	F	44.5	Very low	42.5	Very low	141 Å²	141	92.8 Å²	92.8	62%	0.618	50%	0.495	S	S	*	.	S	Bend	trans	-129.8	63.5	-179.8	-52.5	-74.4	0	0	0	111.8	F209	F209-F213 AromaticContact CD1-CD2 3.78Å; F209-F213 HydrophobicContact CD1-CD2 3.78Å; F209-F213 HydrophobicContact CD1-CE2 4.42Å; F209-F213 AromaticContact CE1-CD2 3.64Å; F209-F213 HydrophobicContact CE1-CD2 3.64Å; F209-F213 HydrophobicContact CE1-CE2 4.03Å; F209-F213 HydrophobicContact CE2-CE2 4.33Å; F209-F213 HydrophobicContact CG-CD2 4.33Å; F209-F213 HydrophobicContact CZ-CD2 4.08Å; F209-F213 AromaticContact CZ-CE2 3.98Å; F209-F213 HydrophobicContact CZ-CE2 3.98Å; F209-F213 PolarHBondContact O-N 3.3Å
214	P	45.2	Very low	43	Very low	38 Å²	38	97 Å²	97	25%	0.247	51%	0.505	C	S	.	.			trans	-64.6	143.5	-177.7	-12.4	25.2	0	0	0	111.6	D210 M211 K216 F221	D210-P214 WeakPolarHBondContact O-CA 3.32Å; D210-P214 WeakPolarHBondContact O-CG 3.33Å; M211-P214 WeakPolarHBondContact O-CD 3.14Å; M211-P214 WeakPolarHBondContact O-CG 3.45Å; P214-K216 PolarHBondContact O-N 3.31Å; P214-F221 HydrophobicContact CB-CD2 3.84Å; P214-F221 HydrophobicContact CB-CE2 3.97Å; P214-F221 HydrophobicContact CG-CD2 4.13Å; P214-F221 HydrophobicContact CG-CE2 4.05Å
215	A	47.3	Very low	43	Very low	64 Å²	64	99.5 Å²	99.5	53%	0.529	51%	0.514	S	S	.	.			trans	-58.9	135.2	170.1	0	0	0	0	0	110.3	D217 T218	A215-D217 PolarHBondContact O-N 3.07Å; A215-T218 HydrophobicContact CB-CG2 4.44Å; A215-T218 PolarHBondContact O-N 2.82Å; A215-T218 VanDerWaalsContact O-N 3.11Å; A215-T218 PolarHBondContact O-OG1 3.27Å
216	K	46	Very low	43.2	Very low	167 Å²	167	104 Å²	104	73%	0.726	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.3	-172.5	-72.6	-177.8	176	178.4	0	113.6	P214 T218	P214-K216 PolarHBondContact O-N 3.31Å; K216-T218 VanDerWaalsContact C-N 3.28Å; K216-T218 PolarHBondContact O-N 3.2Å
217	D	48.9	Very low	43.2	Very low	153 Å²	153	103.8 Å²	103.8	82%	0.818	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	8.1	-172	-42.3	-68.5	0	0	0	113	A215	A215-D217 PolarHBondContact O-N 3.07Å
218	T	48.8	Very low	43.1	Very low	61 Å²	61	107 Å²	107	37%	0.374	55%	0.551	S	S	.	*	S	Bend	trans	-73.8	126.6	175.2	48.7	0	0	0	0	111.5	A215 K216 N220 F221	A215-T218 HydrophobicContact CB-CG2 4.44Å; A215-T218 PolarHBondContact O-N 2.82Å; A215-T218 VanDerWaalsContact O-N 3.11Å; A215-T218 PolarHBondContact O-OG1 3.27Å; K216-T218 VanDerWaalsContact C-N 3.28Å; K216-T218 PolarHBondContact O-N 3.2Å; T218-N220 PolarHBondContact O-N 3.48Å; T218-F221 VanDerWaalsContact O-CB 3.25Å; T218-F221 WeakPolarHBondContact O-CB 3.38Å; T218-F221 PolarHBondContact O-N 3Å
219	P	42.8	Very low	43.1	Very low	118 Å²	118	112 Å²	112	77%	0.766	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	128.7	178.9	25.6	-33	0	0	0	110.4
220	N	44.1	Very low	43.2	Very low	161 Å²	161	109.5 Å²	109.5	86%	0.861	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.7	15.7	-166.6	-47.8	-81.8	0	0	0	116.2	T218 R222	T218-N220 PolarHBondContact O-N 3.48Å; N220-R222 PolarHBondContact O-N 2.97Å
221	F	42.4	Very low	43	Very low	74 Å²	74	107.4 Å²	107.4	33%	0.325	57%	0.567	S	S	.	*			trans	-54.5	112.1	165.5	-178.7	-113	0	0	0	110.9	P214 T218 P223	P214-F221 HydrophobicContact CB-CD2 3.84Å; P214-F221 HydrophobicContact CB-CE2 3.97Å; P214-F221 HydrophobicContact CG-CD2 4.13Å; P214-F221 HydrophobicContact CG-CE2 4.05Å; T218-F221 VanDerWaalsContact O-CB 3.25Å; T218-F221 WeakPolarHBondContact O-CB 3.38Å; T218-F221 PolarHBondContact O-N 3Å; F221-P223 HydrophobicContact CD1-CG 4.35Å; F221-P223 HydrophobicContact CE1-CB 4.42Å; F221-P223 HydrophobicContact CE1-CG 3.82Å; F221-P223 HydrophobicContact CZ-CG 4.42Å
222	R	45.7	Very low	42.9	Very low	220 Å²	220	107 Å²	107	83%	0.83	57%	0.566	S	S	*	*			trans	-105.5	121.4	163	-68.3	-170.3	179.9	-158.4	-0.4	107.2	N220	N220-R222 PolarHBondContact O-N 2.97Å
223	P	43.7	Very low	43	Very low	76 Å²	76	106.9 Å²	106.9	49%	0.494	57%	0.566	S	S	.	*			trans	-54.8	147.1	171.7	-24.1	33.2	0	0	0	111	F221 L225	F221-P223 HydrophobicContact CD1-CG 4.35Å; F221-P223 HydrophobicContact CE1-CB 4.42Å; F221-P223 HydrophobicContact CE1-CG 3.82Å; F221-P223 HydrophobicContact CZ-CG 4.42Å; P223-L225 HydrophobicContact CB-CD1 4.2Å; P223-L225 HydrophobicContact CB-CG 4.17Å; P223-L225 PolarHBondContact O-N 3.39Å
224	W	47.9	Very low	43.1	Very low	108 Å²	108	105.5 Å²	105.5	41%	0.409	56%	0.564	S	S	.	*			trans	-74.1	54.3	177.6	-70.8	80.7	0	0	0	112.3	M211 L212 P232	M211-W224 WeakPolarHBondContact O-CZ2 3.34Å; M211-W224 PolarHBondContact O-NE1 2.96Å; L212-W224 HydrophobicContact CD2-CH2 4.06Å; L212-W224 HydrophobicContact CD2-CZ2 4.19Å; L212-W224 PolarHBondContact O-NE1 3.17Å; W224-P232 HydrophobicContact CH2-CB 3.98Å; W224-P232 HydrophobicContact CH2-CG 3.7Å; W224-P232 HydrophobicContact CZ3-CG 4.09Å
225	L	41	Very low	43.2	Very low	130 Å²	130	107.8 Å²	107.8	68%	0.681	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-74.5	140.5	169.9	-65.8	163.1	0	0	0	108.8	P223 G227	P223-L225 HydrophobicContact CB-CD1 4.2Å; P223-L225 HydrophobicContact CB-CG 4.17Å; P223-L225 PolarHBondContact O-N 3.39Å; L225-G227 VanDerWaalsContact C-N 3.28Å; L225-G227 PolarHBondContact O-N 3.14Å
226	D	40.5	Very low	43	Very low	149 Å²	149	109.1 Å²	109.1	80%	0.797	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	62.2	18.3	171.9	-46.4	-31.9	0	0	0	117.4	H228	D226-H228 VanDerWaalsContact C-N 3.27Å; D226-H228 PolarHBondContact O-N 3.14Å
227	G	37.5	Very low	43	Very low	44 Å²	44	106.3 Å²	106.3	45%	0.454	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	64.3	19.5	159.3	0	0	0	0	0	116.9	L225 F229	L225-G227 VanDerWaalsContact C-N 3.28Å; L225-G227 PolarHBondContact O-N 3.14Å; G227-F229 WeakPolarHBondContact O-CD2 3.49Å; G227-F229 WeakPolarHBondContact O-CE2 3.24Å; G227-F229 PolarHBondContact O-N 3.49Å
228	H	38.7	Very low	43	Very low	139 Å²	139	104.3 Å²	104.3	64%	0.644	54%	0.539	S	S	*	.			trans	-75	93.7	-175.5	-102.6	-82.3	0	0	0	113.3	D226 S230 A231	D226-H228 VanDerWaalsContact C-N 3.27Å; D226-H228 PolarHBondContact O-N 3.14Å; H228-S230 PolarHBondContact O-N 3.15Å; H228-A231 PolarHBondContact O-N 3.38Å
229	F	38.9	Very low	42.9	Very low	168 Å²	168	102.9 Å²	102.9	74%	0.737	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	1.2	177.5	-67	-83.1	0	0	0	116.2	G227 P232	G227-F229 WeakPolarHBondContact O-CD2 3.49Å; G227-F229 WeakPolarHBondContact O-CE2 3.24Å; G227-F229 PolarHBondContact O-N 3.49Å; F229-P232 WeakPolarHBondContact O-CD 3.33Å; F229-P232 WeakPolarHBondContact O-CG 3.36Å
230	S	40.2	Very low	43	Very low	78 Å²	78	102.5 Å²	102.5	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-73.6	-25.7	176.8	47	0	0	0	0	113.9	H228	H228-S230 PolarHBondContact O-N 3.15Å
231	A	39.9	Very low	43.3	Very low	61 Å²	61	102.4 Å²	102.4	50%	0.504	51%	0.509	S	S	.	.	H	α-helix	trans	-67.3	-53.6	176.8	0	0	0	0	0	113.8	H228 D233 L234 Q235	H228-A231 PolarHBondContact O-N 3.38Å; A231-D233 VanDerWaalsContact C-N 3.32Å; A231-D233 PolarHBondContact O-N 2.9Å; A231-L234 PolarHBondContact O-N 3.25Å; A231-Q235 PolarHBondContact O-N 3.38Å
232	P	38.6	Very low	43.6	Very low	14 Å²	14	104.6 Å²	104.6	9%	0.091	52%	0.52	C	S	.	.	H	α-helix	trans	-63.9	-33.8	179	25.4	-37	0	0	0	113	W224 F229 L234 Q235 F236	W224-P232 HydrophobicContact CH2-CB 3.98Å; W224-P232 HydrophobicContact CH2-CG 3.7Å; W224-P232 HydrophobicContact CZ3-CG 4.09Å; F229-P232 WeakPolarHBondContact O-CD 3.33Å; F229-P232 WeakPolarHBondContact O-CG 3.36Å; P232-L234 PolarHBondContact O-N 3.03Å; P232-Q235 PolarHBondContact O-N 3.21Å; P232-F236 HydrophobicContact CB-CD2 4.27Å; P232-F236 HydrophobicContact CB-CE2 4.04Å; P232-F236 WeakPolarHBondContact O-CD2 3.47Å; P232-F236 PolarHBondContact O-N 2.75Å
233	D	41.3	Very low	43.5	Very low	80 Å²	80	98.4 Å²	98.4	43%	0.428	50%	0.497	S	S	.	.	H	α-helix	trans	-60.2	-30.9	177.5	177.3	62.1	0	0	0	112.8	A231 K237	A231-D233 VanDerWaalsContact C-N 3.32Å; A231-D233 PolarHBondContact O-N 2.9Å; D233-K237 WeakPolarHBondContact O-CD 3.49Å; D233-K237 WeakPolarHBondContact O-CG 3.5Å; D233-K237 PolarHBondContact O-N 2.92Å; D233-K237 WeakPolarHBondContact OD1-CE 3.4Å; D233-K237 IonicContact OD1-NZ 3.52Å; D233-K237 PolarHBondContact OD1-NZ 3.17Å; D233-K237 VanDerWaalsContact OD1-NZ 3.12Å; D233-K237 IonicContact OD2-NZ 2.71Å; D233-K237 PolarHBondContact OD2-NZ 3.47Å
234	L	45.3	Very low	43.6	Very low	113 Å²	113	99.9 Å²	99.9	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-72	-39.8	172.5	-165.3	73.4	0	0	0	112.2	A231 P232 K237 Q238	A231-L234 PolarHBondContact O-N 3.25Å; P232-L234 PolarHBondContact O-N 3.03Å; L234-K237 PolarHBondContact O-N 3.44Å; L234-Q238 PolarHBondContact O-N 3.25Å
235	Q	47	Very low	43.6	Very low	86 Å²	86	99.2 Å²	99.2	40%	0.402	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-41	177.9	-69.1	178	-53.2	0	0	111.8	M211 A231 P232 K237 Q238 I239	M211-Q235 HydrophobicContact SD-CB 3.66Å; M211-Q235 HydrophobicContact SD-CG 4.48Å; A231-Q235 PolarHBondContact O-N 3.38Å; P232-Q235 PolarHBondContact O-N 3.21Å; Q235-K237 VanDerWaalsContact C-N 3.27Å; Q235-K237 PolarHBondContact O-N 3.1Å; Q235-Q238 WeakPolarHBondContact O-CB 3.39Å; Q235-Q238 PolarHBondContact O-N 3.07Å; Q235-I239 WeakPolarHBondContact O-CG1 3.5Å; Q235-I239 PolarHBondContact O-N 2.93Å
236	F	42.9	Very low	43.7	Very low	91 Å²	91	99.7 Å²	99.7	40%	0.399	50%	0.502	S	S	.	.	H	α-helix	trans	-55.8	-41.3	174.2	-79.2	-59.5	0	0	0	112.2	I208 M211 P232 Q238 I239 E240	I208-F236 HydrophobicContact CD1-CE1 3.97Å; I208-F236 HydrophobicContact CD1-CZ 4.29Å; I208-F236 HydrophobicContact CG1-CE1 3.82Å; I208-F236 HydrophobicContact CG1-CZ 4.09Å; M211-F236 HydrophobicContact CE-CD1 4.21Å; M211-F236 HydrophobicContact CE-CE1 3.74Å; M211-F236 HydrophobicContact CE-CZ 4.02Å; P232-F236 HydrophobicContact CB-CD2 4.27Å; P232-F236 HydrophobicContact CB-CE2 4.04Å; P232-F236 WeakPolarHBondContact O-CD2 3.47Å; P232-F236 PolarHBondContact O-N 2.75Å; F236-Q238 VanDerWaalsContact C-N 3.32Å; F236-Q238 PolarHBondContact O-N 2.85Å; F236-I239 PolarHBondContact O-N 3.29Å; F236-E240 WeakPolarHBondContact O-CB 3.33Å; F236-E240 PolarHBondContact O-N 3.07Å
237	K	46.9	Very low	43.6	Very low	109 Å²	109	99 Å²	99	47%	0.474	50%	0.497	S	S	.	.	H	α-helix	trans	-66.5	-30.6	176.5	-72.4	163.5	-173.6	163	0	113.2	D233 L234 Q235 K241	D233-K237 WeakPolarHBondContact O-CD 3.49Å; D233-K237 WeakPolarHBondContact O-CG 3.5Å; D233-K237 PolarHBondContact O-N 2.92Å; D233-K237 WeakPolarHBondContact OD1-CE 3.4Å; D233-K237 IonicContact OD1-NZ 3.52Å; D233-K237 PolarHBondContact OD1-NZ 3.17Å; D233-K237 VanDerWaalsContact OD1-NZ 3.12Å; D233-K237 IonicContact OD2-NZ 2.71Å; D233-K237 PolarHBondContact OD2-NZ 3.47Å; L234-K237 PolarHBondContact O-N 3.44Å; Q235-K237 VanDerWaalsContact C-N 3.27Å; Q235-K237 PolarHBondContact O-N 3.1Å; K237-K241 WeakPolarHBondContact O-CB 3.28Å; K237-K241 PolarHBondContact O-N 2.92Å
238	Q	49.3	Very low	43.7	Very low	110 Å²	110	104.8 Å²	104.8	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-72.3	-44.4	173.1	-66.2	178.1	6.2	0	0	111.5	L234 Q235 F236 K241 Q242	L234-Q238 PolarHBondContact O-N 3.25Å; Q235-Q238 WeakPolarHBondContact O-CB 3.39Å; Q235-Q238 PolarHBondContact O-N 3.07Å; F236-Q238 VanDerWaalsContact C-N 3.32Å; F236-Q238 PolarHBondContact O-N 2.85Å; Q238-K241 PolarHBondContact O-N 2.87Å; Q238-Q242 WeakPolarHBondContact O-CG 3.45Å; Q238-Q242 PolarHBondContact O-N 2.96Å
239	I	47.1	Very low	43.7	Very low	31 Å²	31	102.3 Å²	102.3	16%	0.159	51%	0.51	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176.3	-66.3	168.2	0	0	0	110.8	M211 Q235 F236 K241 Q242 R243	M211-I239 HydrophobicContact CE-CD1 3.64Å; M211-I239 HydrophobicContact SD-CD1 3.8Å; Q235-I239 WeakPolarHBondContact O-CG1 3.5Å; Q235-I239 PolarHBondContact O-N 2.93Å; F236-I239 PolarHBondContact O-N 3.29Å; I239-K241 PolarHBondContact O-N 3.47Å; I239-Q242 PolarHBondContact O-N 2.81Å; I239-R243 HydrophobicContact CG2-CG 4.39Å; I239-R243 VanDerWaalsContact CG2-NE 3.32Å; I239-R243 WeakPolarHBondContact O-CB 3.26Å; I239-R243 VanDerWaalsContact O-CG 3.28Å; I239-R243 WeakPolarHBondContact O-CG 3.44Å; I239-R243 PolarHBondContact O-N 3.48Å
240	E	43.2	Very low	43.6	Very low	111 Å²	111	101.7 Å²	101.7	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-57.6	-48.9	175.4	-176	179.2	-167.6	0	0	111.4	F236 Q242 R243 Q244	F236-E240 WeakPolarHBondContact O-CB 3.33Å; F236-E240 PolarHBondContact O-N 3.07Å; E240-Q242 PolarHBondContact O-N 2.9Å; E240-R243 PolarHBondContact O-N 2.83Å; E240-Q244 PolarHBondContact O-N 2.9Å
241	K	50.3	Low	43.5	Very low	158 Å²	158	105 Å²	105	69%	0.687	52%	0.521	S	S	*	.	H	α-helix	trans	-59.2	-46.7	179.2	-170.3	175.7	-178.2	-180	0	111.9	K237 Q238 I239 R243 Q244 T245	K237-K241 WeakPolarHBondContact O-CB 3.28Å; K237-K241 PolarHBondContact O-N 2.92Å; Q238-K241 PolarHBondContact O-N 2.87Å; I239-K241 PolarHBondContact O-N 3.47Å; K241-R243 VanDerWaalsContact C-N 3.34Å; K241-R243 PolarHBondContact O-N 3.11Å; K241-Q244 PolarHBondContact O-N 3.17Å; K241-T245 PolarHBondContact O-N 2.81Å; K241-T245 VanDerWaalsContact O-N 3.12Å; K241-T245 PolarHBondContact O-OG1 3Å; K241-T245 VanDerWaalsContact O-OG1 3.09Å
242	Q	49.2	Very low	43.4	Very low	120 Å²	120	103.9 Å²	103.9	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-61.3	-40.5	176.2	-69.8	-179.6	13.8	0	0	112.5	Q238 I239 E240 T245 K246	Q238-Q242 WeakPolarHBondContact O-CG 3.45Å; Q238-Q242 PolarHBondContact O-N 2.96Å; I239-Q242 PolarHBondContact O-N 2.81Å; E240-Q242 PolarHBondContact O-N 2.9Å; Q242-T245 PolarHBondContact O-N 3.34Å; Q242-K246 PolarHBondContact O-N 2.92Å
243	R	45.1	Very low	43.9	Very low	90 Å²	90	105.1 Å²	105.1	34%	0.34	52%	0.523	S	S	.	.	H	α-helix	trans	-68.7	-37.5	178.7	-73.1	174.4	-179.8	-170.1	3.4	112.2	E207 I239 E240 K241 T245 K246 L247	E207-R243 IonicContact OE2-CZ 3.21Å; E207-R243 IonicContact OE2-NE 3.71Å; E207-R243 IonicContact OE2-NH2 3.16Å; E207-R243 PolarHBondContact OE2-NH2 3.32Å; I239-R243 HydrophobicContact CG2-CG 4.39Å; I239-R243 VanDerWaalsContact CG2-NE 3.32Å; I239-R243 WeakPolarHBondContact O-CB 3.26Å; I239-R243 VanDerWaalsContact O-CG 3.28Å; I239-R243 WeakPolarHBondContact O-CG 3.44Å; I239-R243 PolarHBondContact O-N 3.48Å; E240-R243 PolarHBondContact O-N 2.83Å; K241-R243 VanDerWaalsContact C-N 3.34Å; K241-R243 PolarHBondContact O-N 3.11Å; R243-T245 VanDerWaalsContact C-N 3.34Å; R243-K246 PolarHBondContact O-N 3.05Å; R243-L247 PolarHBondContact O-N 3.44Å
244	Q	44.3	Very low	44.1	Very low	107 Å²	107	104.8 Å²	104.8	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-60.7	-44	170.8	-69.7	-165.8	22.2	0	0	110.9	E240 K241 K246 L247 H248	E240-Q244 PolarHBondContact O-N 2.9Å; K241-Q244 PolarHBondContact O-N 3.17Å; Q244-K246 PolarHBondContact O-N 3.06Å; Q244-L247 PolarHBondContact O-N 3.3Å; Q244-H248 PolarHBondContact O-N 3.41Å; Q244-H248 VanDerWaalsContact O-N 3.1Å; Q244-H248 PolarHBondContact O-ND1 3.1Å
245	T	47.5	Very low	43.9	Very low	94 Å²	94	105.5 Å²	105.5	58%	0.577	53%	0.528	S	S	*	.	H	α-helix	trans	-59.4	-47	174.9	-45.8	0	0	0	0	112	K241 Q242 R243 L247 H248 S249	K241-T245 PolarHBondContact O-N 2.81Å; K241-T245 VanDerWaalsContact O-N 3.12Å; K241-T245 PolarHBondContact O-OG1 3Å; K241-T245 VanDerWaalsContact O-OG1 3.09Å; Q242-T245 PolarHBondContact O-N 3.34Å; R243-T245 VanDerWaalsContact C-N 3.34Å; T245-L247 VanDerWaalsContact C-N 3.33Å; T245-L247 PolarHBondContact O-N 3.2Å; T245-H248 PolarHBondContact O-N 3.49Å; T245-S249 PolarHBondContact O-N 3.2Å; T245-S249 PolarHBondContact O-OG 3.23Å
246	K	44.5	Very low	43.6	Very low	141 Å²	141	109 Å²	109	61%	0.613	54%	0.544	S	S	*	.	H	α-helix	trans	-60.7	-38.1	176.5	-74.9	-178	177.4	177.2	0	112.8	Q242 R243 Q244 S249 Y250	Q242-K246 PolarHBondContact O-N 2.92Å; R243-K246 PolarHBondContact O-N 3.05Å; Q244-K246 PolarHBondContact O-N 3.06Å; K246-S249 WeakPolarHBondContact CA-OG 3.25Å; K246-S249 PolarHBondContact O-N 3.13Å; K246-S249 PolarHBondContact O-OG 2.99Å; K246-Y250 PolarHBondContact O-N 3.3Å
247	L	37.8	Very low	43.5	Very low	134 Å²	134	108.6 Å²	108.6	70%	0.702	54%	0.543	S	S	*	.	H	α-helix	trans	-63.3	-41.5	175.5	-116.3	79	0	0	0	112.4	R243 Q244 T245 S249 Y250	R243-L247 PolarHBondContact O-N 3.44Å; Q244-L247 PolarHBondContact O-N 3.3Å; T245-L247 VanDerWaalsContact C-N 3.33Å; T245-L247 PolarHBondContact O-N 3.2Å; L247-S249 PolarHBondContact O-N 3.43Å; L247-Y250 PolarHBondContact O-N 2.85Å
248	H	39.3	Very low	43.2	Very low	166 Å²	166	109 Å²	109	77%	0.769	55%	0.545	S	S	*	.	H	α-helix	trans	-67.6	-20.5	179.2	-73.9	73.4	0	0	0	112.9	Q244 T245	Q244-H248 PolarHBondContact O-N 3.41Å; Q244-H248 VanDerWaalsContact O-N 3.1Å; Q244-H248 PolarHBondContact O-ND1 3.1Å; T245-H248 PolarHBondContact O-N 3.49Å
249	S	39.9	Very low	42.7	Very low	87 Å²	87	110.2 Å²	110.2	61%	0.608	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.9	174.4	54.5	0	0	0	0	115.3	T245 K246 L247 T251	T245-S249 PolarHBondContact O-N 3.2Å; T245-S249 PolarHBondContact O-OG 3.23Å; K246-S249 WeakPolarHBondContact CA-OG 3.25Å; K246-S249 PolarHBondContact O-N 3.13Å; K246-S249 PolarHBondContact O-OG 2.99Å; L247-S249 PolarHBondContact O-N 3.43Å; S249-T251 PolarHBondContact O-N 3.05Å
250	Y	37	Very low	42.4	Very low	154 Å²	154	116.8 Å²	116.8	60%	0.604	57%	0.571	S	S	*	*			trans	-85.1	108.1	-170	177.1	-110.9	0	0	0	113.3	K246 L247 T253	K246-Y250 PolarHBondContact O-N 3.3Å; L247-Y250 PolarHBondContact O-N 2.85Å; Y250-T253 PolarHBondContact OH-N 3.48Å
251	T	36.7	Very low	42.4	Very low	148 Å²	148	115.7 Å²	115.7	91%	0.908	57%	0.565	S	S	*	*			trans	-89.2	5.1	-178.5	48.5	0	0	0	0	115.2	S249	S249-T251 PolarHBondContact O-N 3.05Å
252	G	37.5	Very low	42	Very low	37 Å²	37	115.4 Å²	115.4	38%	0.381	56%	0.564	S	S	.	*			trans	90.1	146.8	169.9	0	0	0	0	0	116.1
253	T	49.3	Very low	41.4	Very low	40 Å²	40	118.6 Å²	118.6	25%	0.245	57%	0.571	C	S	.	*			trans	-65.9	131.3	176.2	37.9	0	0	0	0	113.2	Y250 K258	Y250-T253 PolarHBondContact OH-N 3.48Å; T253-K258 PolarHBondContact O-NZ 3.25Å; T253-K258 VanDerWaalsContact OG1-CE 3.28Å; T253-K258 WeakPolarHBondContact OG1-CE 3.44Å; T253-K258 PolarHBondContact OG1-NZ 3.23Å
254	T	47.1	Very low	41.3	Very low	74 Å²	74	120 Å²	120	45%	0.454	58%	0.579	S	S	.	*			trans	-67.1	160.6	-178.1	67	0	0	0	0	112.7	Q256 E257 K258	T254-Q256 PolarHBondContact O-N 3.4Å; T254-E257 WeakPolarHBondContact CB-OE2 3.44Å; T254-E257 WeakPolarHBondContact CG2-OE2 3.39Å; T254-E257 PolarHBondContact N-OE2 3.14Å; T254-E257 PolarHBondContact O-N 2.97Å; T254-E257 VanDerWaalsContact OG1-CG 3.3Å; T254-E257 WeakPolarHBondContact OG1-CG 3.4Å; T254-E257 PolarHBondContact OG1-N 3.34Å; T254-E257 PolarHBondContact OG1-OE2 3.37Å; T254-K258 PolarHBondContact O-N 3.43Å; T254-K258 VanDerWaalsContact O-N 3.13Å
255	L	40.9	Very low	41.2	Very low	128 Å²	128	122.4 Å²	122.4	67%	0.67	59%	0.588	S	S	*	*	H	α-helix	trans	-64.9	-29.7	176.1	-158.9	77.7	0	0	0	112.2	K259	L255-K259 WeakPolarHBondContact O-CG 3.36Å; L255-K259 PolarHBondContact O-N 3.32Å; L255-K259 VanDerWaalsContact O-N 3.09Å
256	Q	38.9	Very low	40.8	Very low	158 Å²	158	122.1 Å²	122.1	74%	0.738	58%	0.582	S	S	*	*	H	α-helix	trans	-69.9	-43.8	176.2	-71.4	-172.1	-6.9	0	0	111.8	T254 K258 K259 R260	T254-Q256 PolarHBondContact O-N 3.4Å; Q256-K258 VanDerWaalsContact C-N 3.34Å; Q256-K258 PolarHBondContact O-N 3.01Å; Q256-K259 CarbonylContact O-C 3.59Å; Q256-K259 WeakPolarHBondContact O-CB 3.43Å; Q256-K259 PolarHBondContact O-N 3.24Å; Q256-K259 VanDerWaalsContact O-N 3.15Å; Q256-R260 PolarHBondContact O-N 3.43Å
257	E	40.8	Very low	40.4	Very low	83 Å²	83	120.9 Å²	120.9	39%	0.388	58%	0.581	S	S	.	*	H	α-helix	trans	-63.3	-39.7	174.9	-69.8	165.3	96	0	0	112.1	T254 K259 R260 K261	T254-E257 WeakPolarHBondContact CB-OE2 3.44Å; T254-E257 WeakPolarHBondContact CG2-OE2 3.39Å; T254-E257 PolarHBondContact N-OE2 3.14Å; T254-E257 PolarHBondContact O-N 2.97Å; T254-E257 VanDerWaalsContact OG1-CG 3.3Å; T254-E257 WeakPolarHBondContact OG1-CG 3.4Å; T254-E257 PolarHBondContact OG1-N 3.34Å; T254-E257 PolarHBondContact OG1-OE2 3.37Å; E257-K259 VanDerWaalsContact C-N 3.3Å; E257-K259 PolarHBondContact O-N 3.3Å; E257-R260 PolarHBondContact O-N 2.6Å; E257-R260 VanDerWaalsContact O-N 3.13Å; E257-K261 WeakPolarHBondContact O-CB 3.49Å; E257-K261 WeakPolarHBondContact O-CG 3.29Å; E257-K261 PolarHBondContact O-N 3.48Å
258	K	40.6	Very low	40.6	Very low	117 Å²	117	119.9 Å²	119.9	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-60.1	-39.9	173.2	-76.6	167.3	175.8	139.9	0	111.7	T253 T254 Q256 K262	T253-K258 PolarHBondContact O-NZ 3.25Å; T253-K258 VanDerWaalsContact OG1-CE 3.28Å; T253-K258 WeakPolarHBondContact OG1-CE 3.44Å; T253-K258 PolarHBondContact OG1-NZ 3.23Å; T254-K258 PolarHBondContact O-N 3.43Å; T254-K258 VanDerWaalsContact O-N 3.13Å; Q256-K258 VanDerWaalsContact C-N 3.34Å; Q256-K258 PolarHBondContact O-N 3.01Å; K258-K262 WeakPolarHBondContact O-CB 3.18Å; K258-K262 PolarHBondContact O-N 3.16Å; K258-K262 VanDerWaalsContact O-N 3.1Å
259	K	39.6	Very low	40.6	Very low	136 Å²	136	114.1 Å²	114.1	59%	0.591	55%	0.55	S	S	*	*	H	α-helix	trans	-65.6	-42.9	170.9	-71.6	175.6	179.5	-174.8	0	112.1	L255 Q256 E257 K262 R263	L255-K259 WeakPolarHBondContact O-CG 3.36Å; L255-K259 PolarHBondContact O-N 3.32Å; L255-K259 VanDerWaalsContact O-N 3.09Å; Q256-K259 CarbonylContact O-C 3.59Å; Q256-K259 WeakPolarHBondContact O-CB 3.43Å; Q256-K259 PolarHBondContact O-N 3.24Å; Q256-K259 VanDerWaalsContact O-N 3.15Å; E257-K259 VanDerWaalsContact C-N 3.3Å; E257-K259 PolarHBondContact O-N 3.3Å; K259-K262 PolarHBondContact O-N 3.31Å; K259-R263 PolarHBondContact O-N 3Å
260	R	40.5	Very low	40.7	Very low	169 Å²	169	114 Å²	114	64%	0.638	54%	0.542	S	S	*	.	H	α-helix	trans	-64.9	-47.5	179.7	-165.5	175.5	-172.7	162.9	6.2	112	Q256 E257 K262 R263 K264 H585	Q256-R260 PolarHBondContact O-N 3.43Å; E257-R260 PolarHBondContact O-N 2.6Å; E257-R260 VanDerWaalsContact O-N 3.13Å; R260-K262 VanDerWaalsContact C-N 3.35Å; R260-K262 PolarHBondContact O-N 2.85Å; R260-R263 PolarHBondContact O-N 3.32Å; R260-K264 PolarHBondContact O-N 3.3Å; R260-H585 PolarHBondContact NH2-CE1 3.27Å; R260-H585 VanDerWaalsContact NH2-CE1 3.34Å; R260-H585 PolarHBondContact NH2-NE2 2.8Å; R260-H585 VanDerWaalsContact NH2-NE2 3.17Å
261	K	43.3	Very low	40.8	Very low	89 Å²	89	113.3 Å²	113.3	39%	0.387	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-38.9	174.4	-70	-168.8	176.1	-162	0	111.7	E201 E257 K264 K265	E201-K261 IonicContact OE1-NZ 2.65Å; E201-K261 PolarHBondContact OE1-NZ 3.02Å; E201-K261 IonicContact OE2-NZ 3.97Å; E201-K261 PolarHBondContact OE2-NZ 2.82Å; E257-K261 WeakPolarHBondContact O-CB 3.49Å; E257-K261 WeakPolarHBondContact O-CG 3.29Å; E257-K261 PolarHBondContact O-N 3.48Å; K261-K264 PolarHBondContact O-N 2.92Å; K261-K265 PolarHBondContact O-N 3.04Å
262	K	41.5	Very low	40.9	Very low	152 Å²	152	109.8 Å²	109.8	66%	0.661	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-44	174.5	-166.9	174.4	-176.6	-175.9	0	112.5	K258 K259 R260 K265 I266	K258-K262 WeakPolarHBondContact O-CB 3.18Å; K258-K262 PolarHBondContact O-N 3.16Å; K258-K262 VanDerWaalsContact O-N 3.1Å; K259-K262 PolarHBondContact O-N 3.31Å; R260-K262 VanDerWaalsContact C-N 3.35Å; R260-K262 PolarHBondContact O-N 2.85Å; K262-K265 PolarHBondContact O-N 2.74Å; K262-I266 HydrophobicContact CG-CD1 4.38Å; K262-I266 WeakPolarHBondContact O-CG1 3.45Å; K262-I266 PolarHBondContact O-N 2.65Å
263	R	37.5	Very low	41	Very low	187 Å²	187	110.9 Å²	110.9	71%	0.706	51%	0.514	S	S	*	.	H	α-helix	trans	-60.3	-46	172.3	-77.3	-177	172.6	179.5	-3.2	111.8	K259 R260 K265 I266 L267	K259-R263 PolarHBondContact O-N 3Å; R260-R263 PolarHBondContact O-N 3.32Å; R263-K265 VanDerWaalsContact C-N 3.34Å; R263-K265 PolarHBondContact O-N 2.89Å; R263-I266 PolarHBondContact O-N 2.9Å; R263-L267 WeakPolarHBondContact O-CG 3.36Å; R263-L267 PolarHBondContact O-N 3.06Å; R263-L267 VanDerWaalsContact O-N 3.08Å
264	K	42.3	Very low	40.5	Very low	119 Å²	119	114.2 Å²	114.2	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-58	-42.7	176.9	-171.4	-179.2	-179.7	-175	0	112.3	Y196 R260 K261 L267 K268	Y196-K264 PolarHBondContact OH-NZ 3.06Å; R260-K264 PolarHBondContact O-N 3.3Å; K261-K264 PolarHBondContact O-N 2.92Å; K264-L267 PolarHBondContact O-N 2.92Å; K264-K268 PolarHBondContact O-N 3.33Å; K264-K268 VanDerWaalsContact O-N 3.1Å
265	K	42.1	Very low	39.9	Very low	158 Å²	158	118.3 Å²	118.3	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-42	178	-172.9	164.5	-176.9	167.3	0	112.4	K261 K262 R263 K268 S269	K261-K265 PolarHBondContact O-N 3.04Å; K262-K265 PolarHBondContact O-N 2.74Å; R263-K265 VanDerWaalsContact C-N 3.34Å; R263-K265 PolarHBondContact O-N 2.89Å; K265-K268 PolarHBondContact O-N 2.96Å; K265-S269 PolarHBondContact O-N 3.4Å; K265-S269 VanDerWaalsContact O-N 3.14Å; K265-S269 PolarHBondContact O-OG 2.81Å
266	I	39	Very low	39.6	Very low	87 Å²	87	114.3 Å²	114.3	45%	0.446	52%	0.516	S	S	.	.	H	α-helix	trans	-60.8	-46.8	176.6	-67.4	163.3	0	0	0	110.9	K262 R263 K268 S269 I270	K262-I266 HydrophobicContact CG-CD1 4.38Å; K262-I266 WeakPolarHBondContact O-CG1 3.45Å; K262-I266 PolarHBondContact O-N 2.65Å; R263-I266 PolarHBondContact O-N 2.9Å; I266-K268 PolarHBondContact O-N 3.18Å; I266-S269 PolarHBondContact O-N 3.08Å; I266-I270 HydrophobicContact CG2-CD1 3.87Å; I266-I270 WeakPolarHBondContact O-CG1 3.37Å; I266-I270 PolarHBondContact O-N 2.88Å
267	L	37.8	Very low	39.4	Very low	115 Å²	115	113 Å²	113	60%	0.602	51%	0.513	S	S	*	.	H	α-helix	trans	-63.3	-40.7	179.9	-69.3	169.2	0	0	0	112.7	R263 K264 I270 Q271	R263-L267 WeakPolarHBondContact O-CG 3.36Å; R263-L267 PolarHBondContact O-N 3.06Å; R263-L267 VanDerWaalsContact O-N 3.08Å; K264-L267 PolarHBondContact O-N 2.92Å; L267-I270 PolarHBondContact O-N 3.15Å; L267-Q271 PolarHBondContact O-N 3.33Å
268	K	41.8	Very low	39.1	Very low	113 Å²	113	115.8 Å²	115.8	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-42.1	176.1	-167.3	174.7	-173.6	-79.7	0	111.6	K264 K265 I266 I270 Q271 E272	K264-K268 PolarHBondContact O-N 3.33Å; K264-K268 VanDerWaalsContact O-N 3.1Å; K265-K268 PolarHBondContact O-N 2.96Å; I266-K268 PolarHBondContact O-N 3.18Å; K268-I270 PolarHBondContact O-N 3.06Å; K268-Q271 WeakPolarHBondContact O-CB 3.43Å; K268-Q271 PolarHBondContact O-N 2.97Å; K268-E272 WeakPolarHBondContact CG-OE1 3.27Å; K268-E272 IonicContact NZ-OE1 2.74Å; K268-E272 PolarHBondContact NZ-OE1 3.03Å; K268-E272 VanDerWaalsContact O-CG 3.3Å; K268-E272 WeakPolarHBondContact O-CG 3.49Å; K268-E272 PolarHBondContact O-N 3.32Å
269	S	39.5	Very low	38.6	Very low	46 Å²	46	115.8 Å²	115.8	32%	0.322	53%	0.526	S	S	.	.	H	α-helix	trans	-67.7	-32.1	175.8	-61	0	0	0	0	113.6	K265 I266 E272 I273	K265-S269 PolarHBondContact O-N 3.4Å; K265-S269 VanDerWaalsContact O-N 3.14Å; K265-S269 PolarHBondContact O-OG 2.81Å; I266-S269 PolarHBondContact O-N 3.08Å; S269-E272 WeakPolarHBondContact CA-OE2 3.47Å; S269-E272 PolarHBondContact O-N 3.04Å; S269-I273 WeakPolarHBondContact O-CB 3.11Å; S269-I273 WeakPolarHBondContact O-CD1 3.45Å; S269-I273 WeakPolarHBondContact O-CG1 3.42Å; S269-I273 PolarHBondContact O-N 2.88Å
270	I	40	Very low	38.4	Very low	85 Å²	85	117.8 Å²	117.8	44%	0.436	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-43.4	171.4	-68.7	165.7	0	0	0	110.6	I266 L267 K268 E272 I273 L274	I266-I270 HydrophobicContact CG2-CD1 3.87Å; I266-I270 WeakPolarHBondContact O-CG1 3.37Å; I266-I270 PolarHBondContact O-N 2.88Å; L267-I270 PolarHBondContact O-N 3.15Å; K268-I270 PolarHBondContact O-N 3.06Å; I270-E272 VanDerWaalsContact C-N 3.34Å; I270-E272 PolarHBondContact O-N 3.31Å; I270-I273 PolarHBondContact O-N 2.63Å; I270-L274 HydrophobicContact CG2-CD1 4.04Å; I270-L274 WeakPolarHBondContact O-CG 3.38Å; I270-L274 PolarHBondContact O-N 3.44Å
271	Q	39.8	Very low	38.1	Very low	138 Å²	138	118.1 Å²	118.1	65%	0.645	54%	0.544	S	S	*	.	H	α-helix	trans	-60.5	-42.3	175.3	-176.5	-178.5	0.1	0	0	111.9	L267 K268 L274 W275	L267-Q271 PolarHBondContact O-N 3.33Å; K268-Q271 WeakPolarHBondContact O-CB 3.43Å; K268-Q271 PolarHBondContact O-N 2.97Å; Q271-L274 PolarHBondContact O-N 3.35Å; Q271-W275 WeakPolarHBondContact O-CB 3.5Å; Q271-W275 PolarHBondContact O-N 3.29Å
272	E	39.1	Very low	37.7	Very low	74 Å²	74	121.5 Å²	121.5	35%	0.346	56%	0.561	S	S	.	*	H	α-helix	trans	-66	-40.4	177.1	-71.7	158	170.2	0	0	112.4	K268 S269 I270 W275 L276	K268-E272 WeakPolarHBondContact CG-OE1 3.27Å; K268-E272 IonicContact NZ-OE1 2.74Å; K268-E272 PolarHBondContact NZ-OE1 3.03Å; K268-E272 VanDerWaalsContact O-CG 3.3Å; K268-E272 WeakPolarHBondContact O-CG 3.49Å; K268-E272 PolarHBondContact O-N 3.32Å; S269-E272 WeakPolarHBondContact CA-OE2 3.47Å; S269-E272 PolarHBondContact O-N 3.04Å; I270-E272 VanDerWaalsContact C-N 3.34Å; I270-E272 PolarHBondContact O-N 3.31Å; E272-W275 PolarHBondContact O-N 3.44Å; E272-L276 WeakPolarHBondContact O-CG 3.29Å; E272-L276 PolarHBondContact O-N 3.47Å
273	I	38.9	Very low	37.4	Very low	61 Å²	61	118.3 Å²	118.3	31%	0.313	55%	0.551	S	S	.	*	H	α-helix	trans	-62.6	-45.1	174.5	-72.1	163.5	0	0	0	111.1	S269 I270 W275 L276 L277	S269-I273 WeakPolarHBondContact O-CB 3.11Å; S269-I273 WeakPolarHBondContact O-CD1 3.45Å; S269-I273 WeakPolarHBondContact O-CG1 3.42Å; S269-I273 PolarHBondContact O-N 2.88Å; I270-I273 PolarHBondContact O-N 2.63Å; I273-W275 VanDerWaalsContact C-N 3.3Å; I273-W275 PolarHBondContact O-N 3.02Å; I273-L276 PolarHBondContact O-N 3.46Å; I273-L277 HydrophobicContact CG2-CD1 4.02Å; I273-L277 WeakPolarHBondContact O-CG 3.14Å; I273-L277 PolarHBondContact O-N 3.24Å
274	L	38.9	Very low	37.4	Very low	109 Å²	109	115.6 Å²	115.6	57%	0.571	55%	0.55	S	S	*	*	H	α-helix	trans	-63.9	-36	176.8	-69.4	168.4	0	0	0	112	I270 Q271 H278	I270-L274 HydrophobicContact CG2-CD1 4.04Å; I270-L274 WeakPolarHBondContact O-CG 3.38Å; I270-L274 PolarHBondContact O-N 3.44Å; Q271-L274 PolarHBondContact O-N 3.35Å; L274-H278 WeakPolarHBondContact O-CB 3.41Å; L274-H278 PolarHBondContact O-N 3.22Å; L274-H278 VanDerWaalsContact O-N 3.13Å
275	W	35.9	Very low	36.9	Very low	160 Å²	160	117.8 Å²	117.8	61%	0.606	56%	0.56	S	S	*	*	H	α-helix	trans	-69.6	-37.1	176.7	-168	83.1	0	0	0	112.9	Q271 E272 I273 H278 F279	Q271-W275 WeakPolarHBondContact O-CB 3.5Å; Q271-W275 PolarHBondContact O-N 3.29Å; E272-W275 PolarHBondContact O-N 3.44Å; I273-W275 VanDerWaalsContact C-N 3.3Å; I273-W275 PolarHBondContact O-N 3.02Å; W275-H278 WeakPolarHBondContact O-CB 3.21Å; W275-H278 PolarHBondContact O-N 3.35Å; W275-F279 HydrophobicContact CZ2-CD2 4.33Å; W275-F279 HydrophobicContact CZ2-CE2 4.45Å; W275-F279 PolarHBondContact O-N 3.47Å
276	L	33.7	Very low	36.5	Very low	44 Å²	44	113.6 Å²	113.6	23%	0.23	55%	0.545	C	S	.	.	H	α-helix	trans	-69.8	-41.6	174.6	-71.4	165.7	0	0	0	112.3	E272 I273 H278 F279 Q280 L286	E272-L276 WeakPolarHBondContact O-CG 3.29Å; E272-L276 PolarHBondContact O-N 3.47Å; I273-L276 PolarHBondContact O-N 3.46Å; L276-H278 PolarHBondContact O-N 2.62Å; L276-F279 PolarHBondContact O-N 3.48Å; L276-F279 VanDerWaalsContact O-N 3.15Å; L276-Q280 PolarHBondContact O-N 2.94Å; L276-L286 HydrophobicContact CD1-CD1 3.98Å; L276-L286 HydrophobicContact CD1-CD2 3.88Å; L276-L286 HydrophobicContact CD1-CG 4.47Å
277	L	34.9	Very low	36.3	Very low	132 Å²	132	112.1 Å²	112.1	69%	0.691	54%	0.536	S	S	*	.	H	α-helix	trans	-60	-32.6	173.4	-74.4	168	0	0	0	112.4	I273	I273-L277 HydrophobicContact CG2-CD1 4.02Å; I273-L277 WeakPolarHBondContact O-CG 3.14Å; I273-L277 PolarHBondContact O-N 3.24Å
278	H	35.2	Very low	36.2	Very low	141 Å²	141	109.5 Å²	109.5	65%	0.653	53%	0.528	S	S	*	.	H	α-helix	trans	-71.6	-26.9	176.7	177.5	47.1	0	0	0	113.8	L274 W275 L276	L274-H278 WeakPolarHBondContact O-CB 3.41Å; L274-H278 PolarHBondContact O-N 3.22Å; L274-H278 VanDerWaalsContact O-N 3.13Å; W275-H278 WeakPolarHBondContact O-CB 3.21Å; W275-H278 PolarHBondContact O-N 3.35Å; L276-H278 PolarHBondContact O-N 2.62Å
279	F	29.3	Very low	35.8	Very low	117 Å²	117	107.3 Å²	107.3	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-112.8	-5	-168.8	-98.3	-73.5	0	0	0	117	W275 L276 K281	W275-F279 HydrophobicContact CZ2-CD2 4.33Å; W275-F279 HydrophobicContact CZ2-CE2 4.45Å; W275-F279 PolarHBondContact O-N 3.47Å; L276-F279 PolarHBondContact O-N 3.48Å; L276-F279 VanDerWaalsContact O-N 3.15Å; F279-K281 PolarHBondContact O-N 3.12Å
280	Q	36.5	Very low	35.5	Very low	178 Å²	178	106.2 Å²	106.2	83%	0.832	52%	0.516	S	S	*	.			trans	51.4	18.9	176.2	-68.7	-167.4	-13.8	0	0	116.9	L276 H282	L276-Q280 PolarHBondContact O-N 2.94Å; Q280-H282 PolarHBondContact O-N 2.87Å
281	K	33.5	Very low	35.1	Very low	176 Å²	176	108.1 Å²	108.1	77%	0.765	52%	0.518	S	S	*	.			trans	-82.4	117.7	173.7	-86.4	-169.8	170.8	-177.2	0	111.2	F279 D283	F279-K281 PolarHBondContact O-N 3.12Å; K281-D283 PolarHBondContact O-N 2.75Å
282	H	35.3	Very low	34.7	Very low	160 Å²	160	107.1 Å²	107.1	74%	0.741	52%	0.516	S	S	*	.			trans	-66.5	126.7	165.5	-75.7	-89.4	0	0	0	110.3	Q280 E287	Q280-H282 PolarHBondContact O-N 2.87Å; H282-E287 IonicContact ND1-OE2 2.6Å
283	D	34.8	Very low	34.3	Very low	84 Å²	84	106.1 Å²	106.1	45%	0.449	52%	0.515	S	S	.	.			trans	-132.2	107.2	166.2	179.2	-48.7	0	0	0	105.9	K281 F285 L286 E287	K281-D283 PolarHBondContact O-N 2.75Å; D283-F285 PolarHBondContact O-N 2.66Å; D283-F285 PolarHBondContact OD1-N 2.91Å; D283-F285 VanDerWaalsContact OD1-N 3.16Å; D283-L286 HydrophobicContact CB-CB 4.01Å; D283-L286 CarbonylContact O-C 3.51Å; D283-L286 PolarHBondContact O-N 2.76Å; D283-L286 PolarHBondContact OD1-N 3.28Å; D283-E287 WeakPolarHBondContact O-CB 3.43Å; D283-E287 PolarHBondContact O-N 3.17Å
284	D	36.3	Very low	34	Very low	130 Å²	130	106 Å²	106	70%	0.695	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-28.1	-168.7	-60.4	-46.6	0	0	0	113.1	S288	D284-S288 PolarHBondContact O-N 3.25Å
285	F	33.3	Very low	33.6	Very low	165 Å²	165	107.3 Å²	107.3	72%	0.724	52%	0.515	S	S	*	.	H	α-helix	trans	-75.3	-44.1	179.3	-171.8	-97.8	0	0	0	110.4	D283 E287 S288 T289	D283-F285 PolarHBondContact O-N 2.66Å; D283-F285 PolarHBondContact OD1-N 2.91Å; D283-F285 VanDerWaalsContact OD1-N 3.16Å; F285-E287 VanDerWaalsContact C-N 3.32Å; F285-S288 PolarHBondContact O-N 2.99Å; F285-S288 PolarHBondContact O-OG 2.83Å; F285-T289 PolarHBondContact O-N 2.91Å; F285-T289 VanDerWaalsContact O-N 3.16Å; F285-T289 PolarHBondContact O-OG1 3.48Å
286	L	33.7	Very low	33.4	Very low	71 Å²	71	105.2 Å²	105.2	37%	0.372	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-34.3	171.3	-121.8	167	0	0	0	111.5	L276 D283 T289 S290	L276-L286 HydrophobicContact CD1-CD1 3.98Å; L276-L286 HydrophobicContact CD1-CD2 3.88Å; L276-L286 HydrophobicContact CD1-CG 4.47Å; D283-L286 HydrophobicContact CB-CB 4.01Å; D283-L286 CarbonylContact O-C 3.51Å; D283-L286 PolarHBondContact O-N 2.76Å; D283-L286 PolarHBondContact OD1-N 3.28Å; L286-T289 PolarHBondContact O-N 2.97Å; L286-S290 VanDerWaalsContact O-CB 3.26Å; L286-S290 WeakPolarHBondContact O-CB 3.15Å; L286-S290 PolarHBondContact O-N 3.28Å; L286-S290 PolarHBondContact O-OG 3.01Å; L286-S290 VanDerWaalsContact O-OG 3.12Å
287	E	34.1	Very low	33.3	Very low	55 Å²	55	110.3 Å²	110.3	26%	0.257	54%	0.537	S	S	.	.	H	α-helix	trans	-66.7	-38.8	173	-152.8	-165.3	126.2	0	0	111.3	H282 D283 F285 T289 S290 R291	H282-E287 IonicContact ND1-OE2 2.6Å; D283-E287 WeakPolarHBondContact O-CB 3.43Å; D283-E287 PolarHBondContact O-N 3.17Å; F285-E287 VanDerWaalsContact C-N 3.32Å; E287-T289 VanDerWaalsContact C-N 3.3Å; E287-T289 PolarHBondContact O-N 3.34Å; E287-S290 PolarHBondContact O-N 3.01Å; E287-R291 HydrophobicContact CG-CG 4.5Å; E287-R291 VanDerWaalsContact O-CB 3.28Å; E287-R291 WeakPolarHBondContact O-CB 3.35Å; E287-R291 WeakPolarHBondContact O-CG 3.13Å; E287-R291 PolarHBondContact O-N 3.39Å; E287-R291 IonicContact OE1-CZ 2.71Å; E287-R291 IonicContact OE1-NE 2.73Å; E287-R291 PolarHBondContact OE1-NE 3.32Å; E287-R291 IonicContact OE1-NH2 2.68Å; E287-R291 PolarHBondContact OE1-NH2 3.42Å
288	S	35.1	Very low	33.3	Very low	61 Å²	61	106.5 Å²	106.5	43%	0.427	52%	0.521	S	S	.	.	H	α-helix	trans	-61.5	-38.6	174.2	83.2	0	0	0	0	112.3	D284 F285 L292	D284-S288 PolarHBondContact O-N 3.25Å; F285-S288 PolarHBondContact O-N 2.99Å; F285-S288 PolarHBondContact O-OG 2.83Å; S288-L292 PolarHBondContact O-N 3.43Å
289	T	33.8	Very low	33.2	Very low	67 Å²	67	100.8 Å²	100.8	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-76.3	-37.2	178.5	-54.6	0	0	0	0	111.9	F285 L286 E287 L292 T293	F285-T289 PolarHBondContact O-N 2.91Å; F285-T289 VanDerWaalsContact O-N 3.16Å; F285-T289 PolarHBondContact O-OG1 3.48Å; L286-T289 PolarHBondContact O-N 2.97Å; E287-T289 VanDerWaalsContact C-N 3.3Å; E287-T289 PolarHBondContact O-N 3.34Å; T289-L292 WeakPolarHBondContact O-CB 3.4Å; T289-L292 PolarHBondContact O-N 3.33Å; T289-T293 PolarHBondContact O-N 2.82Å; T289-T293 PolarHBondContact O-OG1 3.36Å
290	S	33.8	Very low	33.5	Very low	23 Å²	23	102 Å²	102	16%	0.161	50%	0.504	C	S	.	.	H	α-helix	trans	-66	-43.8	171.5	-74	0	0	0	0	111	L286 E287 L292 T293 I294	L286-S290 VanDerWaalsContact O-CB 3.26Å; L286-S290 WeakPolarHBondContact O-CB 3.15Å; L286-S290 PolarHBondContact O-N 3.28Å; L286-S290 PolarHBondContact O-OG 3.01Å; L286-S290 VanDerWaalsContact O-OG 3.12Å; E287-S290 PolarHBondContact O-N 3.01Å; S290-L292 PolarHBondContact O-N 3.45Å; S290-T293 CarbonylContact O-C 3.06Å; S290-T293 PolarHBondContact O-N 3.08Å; S290-I294 WeakPolarHBondContact O-CB 3.29Å; S290-I294 VanDerWaalsContact O-CG1 3.25Å; S290-I294 WeakPolarHBondContact O-CG1 3.48Å; S290-I294 PolarHBondContact O-N 3.1Å
291	R	31.4	Very low	33.5	Very low	125 Å²	125	96.8 Å²	96.8	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-56.9	-31.7	172.3	-75.2	169.9	-177.8	-159.9	8.3	112.1	E287 K295 F301	E287-R291 HydrophobicContact CG-CG 4.5Å; E287-R291 VanDerWaalsContact O-CB 3.28Å; E287-R291 WeakPolarHBondContact O-CB 3.35Å; E287-R291 WeakPolarHBondContact O-CG 3.13Å; E287-R291 PolarHBondContact O-N 3.39Å; E287-R291 IonicContact OE1-CZ 2.71Å; E287-R291 IonicContact OE1-NE 2.73Å; E287-R291 PolarHBondContact OE1-NE 3.32Å; E287-R291 IonicContact OE1-NH2 2.68Å; E287-R291 PolarHBondContact OE1-NH2 3.42Å; R291-K295 WeakPolarHBondContact O-CB 3.37Å; R291-K295 WeakPolarHBondContact O-CG 3.31Å; R291-K295 PolarHBondContact O-N 3.45Å; R291-K295 VanDerWaalsContact O-N 3.17Å; R291-F301 HydrophobicContact CG-CZ 4.49Å
292	L	32.1	Very low	33.8	Very low	116 Å²	116	90.7 Å²	90.7	61%	0.607	45%	0.454	S	S	*	.	H	α-helix	trans	-75.9	-38.4	173.5	-144.5	83.9	0	0	0	112.5	S288 T289 S290 K295 N296	S288-L292 PolarHBondContact O-N 3.43Å; T289-L292 WeakPolarHBondContact O-CB 3.4Å; T289-L292 PolarHBondContact O-N 3.33Å; S290-L292 PolarHBondContact O-N 3.45Å; L292-K295 WeakPolarHBondContact O-CB 3.33Å; L292-N296 PolarHBondContact O-ND2 3.4Å; L292-N296 VanDerWaalsContact O-ND2 3.07Å
293	T	30.7	Very low	33.8	Very low	53 Å²	53	92 Å²	92	33%	0.325	46%	0.461	S	S	.	.	H	α-helix	trans	-73.9	-41.9	179.4	-56.2	0	0	0	0	112	T289 S290 K295 N296 F297	T289-T293 PolarHBondContact O-N 2.82Å; T289-T293 PolarHBondContact O-OG1 3.36Å; S290-T293 CarbonylContact O-C 3.06Å; S290-T293 PolarHBondContact O-N 3.08Å; T293-K295 VanDerWaalsContact C-N 3.32Å; T293-N296 CarbonylContact O-C 3.57Å; T293-N296 WeakPolarHBondContact O-CA 3.38Å; T293-N296 WeakPolarHBondContact O-CB 3.28Å; T293-N296 PolarHBondContact O-N 2.82Å; T293-F297 HydrophobicContact CG2-CD2 4.24Å; T293-F297 PolarHBondContact O-N 3.19Å; T293-F297 VanDerWaalsContact O-N 3.1Å
294	I	31.8	Very low	33.9	Very low	58 Å²	58	94.2 Å²	94.2	30%	0.297	47%	0.468	S	S	.	.	H	α-helix	trans	-67.6	-29.9	174.5	-69.4	167	0	0	0	111.1	S290 N296 F297 S298 C299	S290-I294 WeakPolarHBondContact O-CB 3.29Å; S290-I294 VanDerWaalsContact O-CG1 3.25Å; S290-I294 WeakPolarHBondContact O-CG1 3.48Å; S290-I294 PolarHBondContact O-N 3.1Å; I294-N296 PolarHBondContact O-N 2.96Å; I294-F297 CarbonylContact O-C 3.57Å; I294-F297 PolarHBondContact O-N 3.29Å; I294-F297 VanDerWaalsContact O-N 3.08Å; I294-F297 VanDerWaalsContact O-O 3.13Å; I294-S298 PolarHBondContact O-N 3.47Å; I294-C299 HydrophobicContact CG2-CB 3.48Å; I294-C299 VanDerWaalsContact CG2-CB 3.48Å; I294-C299 PolarHBondContact O-N 3.45Å
295	K	30.3	Very low	33.6	Very low	137 Å²	137	96.2 Å²	96.2	60%	0.596	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.9	165.1	-98	-176	173.1	-178.3	0	113.7	R291 L292 T293 F301	R291-K295 WeakPolarHBondContact O-CB 3.37Å; R291-K295 WeakPolarHBondContact O-CG 3.31Å; R291-K295 PolarHBondContact O-N 3.45Å; R291-K295 VanDerWaalsContact O-N 3.17Å; L292-K295 WeakPolarHBondContact O-CB 3.33Å; T293-K295 VanDerWaalsContact C-N 3.32Å; K295-F301 HydrophobicContact CG-CE2 4.21Å
296	N	32.8	Very low	33.4	Very low	116 Å²	116	95.7 Å²	95.7	62%	0.62	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-10.1	174.2	-57.6	-44.7	0	0	0	112.6	L292 T293 I294	L292-N296 PolarHBondContact O-ND2 3.4Å; L292-N296 VanDerWaalsContact O-ND2 3.07Å; T293-N296 CarbonylContact O-C 3.57Å; T293-N296 WeakPolarHBondContact O-CA 3.38Å; T293-N296 WeakPolarHBondContact O-CB 3.28Å; T293-N296 PolarHBondContact O-N 2.82Å; I294-N296 PolarHBondContact O-N 2.96Å
297	F	31.5	Very low	33.3	Very low	151 Å²	151	96.2 Å²	96.2	66%	0.662	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	71.7	178.3	-73.7	-74.3	0	0	0	110.7	T293 I294 C299	T293-F297 HydrophobicContact CG2-CD2 4.24Å; T293-F297 PolarHBondContact O-N 3.19Å; T293-F297 VanDerWaalsContact O-N 3.1Å; I294-F297 CarbonylContact O-C 3.57Å; I294-F297 PolarHBondContact O-N 3.29Å; I294-F297 VanDerWaalsContact O-N 3.08Å; I294-F297 VanDerWaalsContact O-O 3.13Å; F297-C299 PolarHBondContact O-N 3.39Å
298	S	34.3	Very low	33.2	Very low	52 Å²	52	99 Å²	99	36%	0.364	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	28.6	152.2	-49.3	0	0	0	0	119.2	I294	I294-S298 PolarHBondContact O-N 3.47Å
299	C	31.9	Very low	33.1	Very low	22 Å²	22	102 Å²	102	15%	0.149	49%	0.491	C	S	.	.			trans	-117.2	139.1	160.5	-62.1	0	0	0	0	112	I294 F297 L307	I294-C299 HydrophobicContact CG2-CB 3.48Å; I294-C299 VanDerWaalsContact CG2-CB 3.48Å; I294-C299 PolarHBondContact O-N 3.45Å; F297-C299 PolarHBondContact O-N 3.39Å; C299-L307 HydrophobicContact CB-CD1 4.16Å
300	H	37	Very low	33.1	Very low	141 Å²	141	103.4 Å²	103.4	65%	0.653	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	154.6	177	-74	71.2	0	0	0	110.7	K308	H300-K308 WeakPolarHBondContact O-CA 3.45Å; H300-K308 WeakPolarHBondContact O-CB 3.45Å; H300-K308 PolarHBondContact O-N 3.47Å
301	F	35.5	Very low	32.8	Very low	69 Å²	69	109.9 Å²	109.9	30%	0.303	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	143.9	168.7	-69.3	-96.4	0	0	0	108.7	R291 K295 Q305 R306 L307	R291-F301 HydrophobicContact CG-CZ 4.49Å; K295-F301 HydrophobicContact CG-CE2 4.21Å; F301-Q305 WeakPolarHBondContact CD1-O 3.47Å; F301-R306 WeakPolarHBondContact CA-O 3.42Å; F301-L307 HydrophobicContact CD1-CB 4.31Å; F301-L307 HydrophobicContact CE1-CB 3.88Å; F301-L307 HydrophobicContact CE1-CD1 3.91Å; F301-L307 HydrophobicContact CE2-CD1 4.04Å; F301-L307 HydrophobicContact CZ-CB 4.46Å; F301-L307 HydrophobicContact CZ-CD1 3.64Å
302	D	41	Very low	32.8	Very low	48 Å²	48	110 Å²	110	26%	0.257	53%	0.527	S	S	.	.			trans	-76.6	175.2	173	74.7	2.4	0	0	0	112.3	H304 Q305 R306	D302-H304 PolarHBondContact O-N 3.12Å; D302-H304 VanDerWaalsContact OD1-C 3.26Å; D302-H304 WeakPolarHBondContact OD1-CA 3.49Å; D302-H304 WeakPolarHBondContact OD1-CB 3.43Å; D302-H304 PolarHBondContact OD1-N 2.9Å; D302-Q305 PolarHBondContact O-N 3.36Å; D302-Q305 PolarHBondContact OD1-N 2.74Å; D302-R306 PolarHBondContact N-O 2.98Å; D302-R306 WeakPolarHBondContact OD1-CB 3.32Å; D302-R306 PolarHBondContact OD1-N 3.11Å; D302-R306 IonicContact OD1-NE 2.63Å; D302-R306 IonicContact OD2-CZ 2.79Å; D302-R306 IonicContact OD2-NE 3.63Å; D302-R306 PolarHBondContact OD2-NE 3.3Å; D302-R306 IonicContact OD2-NH2 3.88Å; D302-R306 PolarHBondContact OD2-NH2 3.14Å
303	E	33.7	Very low	32.8	Very low	187 Å²	187	109.1 Å²	109.1	87%	0.874	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-7.3	178.3	-63.9	175.2	-160.6	0	0	113.6
304	H	37.2	Very low	32.8	Very low	132 Å²	132	110.9 Å²	110.9	61%	0.611	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	17.5	176.4	-49.8	-34.4	0	0	0	111.9	D302 R306	D302-H304 PolarHBondContact O-N 3.12Å; D302-H304 VanDerWaalsContact OD1-C 3.26Å; D302-H304 WeakPolarHBondContact OD1-CA 3.49Å; D302-H304 WeakPolarHBondContact OD1-CB 3.43Å; D302-H304 PolarHBondContact OD1-N 2.9Å; H304-R306 PolarHBondContact O-N 3.01Å
305	Q	30.7	Very low	32.9	Very low	171 Å²	171	112.4 Å²	112.4	80%	0.799	54%	0.538	S	S	*	.			trans	57.9	24.4	-179.6	-55.2	-168.1	24.3	0	0	115.3	F301 D302	F301-Q305 WeakPolarHBondContact CD1-O 3.47Å; D302-Q305 PolarHBondContact O-N 3.36Å; D302-Q305 PolarHBondContact OD1-N 2.74Å
306	R	29.2	Very low	32.8	Very low	154 Å²	154	108.8 Å²	108.8	58%	0.581	53%	0.53	S	S	*	.			trans	-85.3	135.1	174	-58.4	178.1	-62.4	-167.2	0.7	109.8	F301 D302 H304 K308	F301-R306 WeakPolarHBondContact CA-O 3.42Å; D302-R306 PolarHBondContact N-O 2.98Å; D302-R306 WeakPolarHBondContact OD1-CB 3.32Å; D302-R306 PolarHBondContact OD1-N 3.11Å; D302-R306 IonicContact OD1-NE 2.63Å; D302-R306 IonicContact OD2-CZ 2.79Å; D302-R306 IonicContact OD2-NE 3.63Å; D302-R306 PolarHBondContact OD2-NE 3.3Å; D302-R306 IonicContact OD2-NH2 3.88Å; D302-R306 PolarHBondContact OD2-NH2 3.14Å; H304-R306 PolarHBondContact O-N 3.01Å; R306-K308 PolarHBondContact O-N 3.43Å
307	L	30.8	Very low	32.9	Very low	82 Å²	82	104.1 Å²	104.1	43%	0.429	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	116.3	177.1	-179.1	69.7	0	0	0	109.4	C299 F301	C299-L307 HydrophobicContact CB-CD1 4.16Å; F301-L307 HydrophobicContact CD1-CB 4.31Å; F301-L307 HydrophobicContact CE1-CB 3.88Å; F301-L307 HydrophobicContact CE1-CD1 3.91Å; F301-L307 HydrophobicContact CE2-CD1 4.04Å; F301-L307 HydrophobicContact CZ-CB 4.46Å; F301-L307 HydrophobicContact CZ-CD1 3.64Å
308	K	33.2	Very low	32.8	Very low	114 Å²	114	102.5 Å²	102.5	50%	0.496	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	95.6	176.5	-159.1	-179.2	-179.7	-168.7	0	108.5	H300 R306	H300-K308 WeakPolarHBondContact O-CA 3.45Å; H300-K308 WeakPolarHBondContact O-CB 3.45Å; H300-K308 PolarHBondContact O-N 3.47Å; R306-K308 PolarHBondContact O-N 3.43Å
309	L	33.2	Very low	32.6	Very low	123 Å²	123	102.9 Å²	102.9	64%	0.644	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-54.9	143.8	160.6	-76	161.6	0	0	0	109	R311	L309-R311 PolarHBondContact O-N 3.34Å
310	L	32.2	Very low	32.3	Very low	97 Å²	97	104.6 Å²	104.6	51%	0.508	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-53.6	129.1	165.4	-69.9	166.5	0	0	0	108.1	D314	L310-D314 WeakPolarHBondContact CA-OD2 3.47Å; L310-D314 HydrophobicContact CD2-CB 4.08Å
311	R	28.5	Very low	32	Very low	159 Å²	159	104.1 Å²	104.1	60%	0.6	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-84	156.1	176.1	-65	-177.6	175.7	-174.3	-3.2	108.1	L309 N313 D314	L309-R311 PolarHBondContact O-N 3.34Å; R311-N313 PolarHBondContact O-N 2.8Å; R311-D314 PolarHBondContact N-OD2 2.72Å; R311-D314 VanDerWaalsContact O-CB 3.32Å; R311-D314 WeakPolarHBondContact O-CB 3.41Å; R311-D314 PolarHBondContact O-N 2.99Å
312	N	31.3	Very low	31.6	Very low	129 Å²	129	108.6 Å²	108.6	69%	0.69	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-55.6	-28.6	177.8	-64.8	-0.8	0	0	0	112.5	D314 L315 S316	N312-D314 PolarHBondContact O-N 3.12Å; N312-L315 PolarHBondContact O-N 3Å; N312-S316 VanDerWaalsContact O-CB 3.26Å; N312-S316 WeakPolarHBondContact O-CB 3.45Å; N312-S316 PolarHBondContact O-N 3.2Å
313	N	31	Very low	31.2	Very low	97 Å²	97	112.6 Å²	112.6	52%	0.519	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-57.8	-23.4	172.4	-56	50.7	0	0	0	114.4	R311 L315	R311-N313 PolarHBondContact O-N 2.8Å; N313-L315 VanDerWaalsContact C-N 3.3Å
314	D	30.8	Very low	31	Very low	89 Å²	89	106.6 Å²	106.6	48%	0.476	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-84.5	-6.5	-177.9	-52.8	-34.5	0	0	0	111.9	L310 R311 N312	L310-D314 WeakPolarHBondContact CA-OD2 3.47Å; L310-D314 HydrophobicContact CD2-CB 4.08Å; R311-D314 PolarHBondContact N-OD2 2.72Å; R311-D314 VanDerWaalsContact O-CB 3.32Å; R311-D314 WeakPolarHBondContact O-CB 3.41Å; R311-D314 PolarHBondContact O-N 2.99Å; N312-D314 PolarHBondContact O-N 3.12Å
315	L	34.3	Very low	30.8	Very low	91 Å²	91	105.1 Å²	105.1	48%	0.476	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-3.7	180	-72.6	171.3	0	0	0	114.2	N312 N313 L317	N312-L315 PolarHBondContact O-N 3Å; N313-L315 VanDerWaalsContact C-N 3.3Å; L315-L317 PolarHBondContact O-N 2.77Å
316	S	29.3	Very low	30.5	Very low	60 Å²	60	104.7 Å²	104.7	42%	0.42	54%	0.538	S	S	.	.			trans	-73.9	101.8	-164.9	57.2	0	0	0	0	115.2	N312 I318	N312-S316 VanDerWaalsContact O-CB 3.26Å; N312-S316 WeakPolarHBondContact O-CB 3.45Å; N312-S316 PolarHBondContact O-N 3.2Å; S316-I318 PolarHBondContact O-N 3.37Å
317	L	34.4	Very low	30.6	Very low	19 Å²	19	105.7 Å²	105.7	10%	0.099	56%	0.555	C	S	.	*			trans	-84.1	77.6	167.5	-133.6	173.7	0	0	0	112.6	L315 V343 F376 V439 F475	L315-L317 PolarHBondContact O-N 2.77Å; L317-V343 HydrophobicContact CD1-CG2 4.46Å; L317-F376 HydrophobicContact CD1-CD1 3.42Å; L317-F376 VanDerWaalsContact CD1-CD1 3.42Å; L317-F376 HydrophobicContact CD1-CE1 3.61Å; L317-V439 HydrophobicContact CD2-CG2 4.26Å; L317-F475 HydrophobicContact CD1-CZ 4.19Å; L317-F475 HydrophobicContact CD2-CE1 3.98Å; L317-F475 HydrophobicContact CD2-CE2 4.5Å; L317-F475 HydrophobicContact CD2-CZ 3.67Å; L317-F475 HydrophobicContact CG-CE1 4.35Å; L317-F475 HydrophobicContact CG-CE2 4.32Å; L317-F475 HydrophobicContact CG-CZ 3.6Å
318	I	29.2	Very low	30.2	Very low	117 Å²	117	107.3 Å²	107.3	60%	0.6	57%	0.569	S	S	*	*			trans	-127.9	114.3	173.6	-55.3	179.3	0	0	0	109	S316	S316-I318 PolarHBondContact O-N 3.37Å
319	C	29.8	Very low	29.9	Very low	60 Å²	60	107 Å²	107	41%	0.405	58%	0.578	S	S	.	*			trans	-115.8	123	176	-170.8	0	0	0	0	109.7	Y321 I453	C319-Y321 HydrophobicContact CB-CE2 4.42Å; C319-Y321 PolarHBondContact SG-OH 2.96Å; C319-I453 HydrophobicContact CB-CD1 3.55Å; C319-I453 VanDerWaalsContact SG-CD1 3.57Å
320	N	26.4	Very low	29.8	Very low	57 Å²	57	108.6 Å²	108.6	31%	0.305	59%	0.586	S	S	.	*			trans	-114.2	132.4	-174.8	-175	-0.6	0	0	0	110.7	Q322 I323 Q333	N320-Q322 PolarHBondContact OD1-N 2.97Å; N320-Q322 VanDerWaalsContact OD1-N 3.11Å; N320-I323 HydrophobicContact CB-CD1 4.26Å; N320-I323 HydrophobicContact CB-CG1 4.19Å; N320-Q333 PolarHBondContact ND2-OE1 3.29Å
321	Y	30.5	Very low	29.5	Very low	132 Å²	132	111.5 Å²	111.5	52%	0.518	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	-7.2	-173.8	-73.9	-87.7	0	0	0	113.8	C319 R341 I453	C319-Y321 HydrophobicContact CB-CE2 4.42Å; C319-Y321 PolarHBondContact SG-OH 2.96Å; Y321-R341 VanDerWaalsContact CE2-CZ 3.43Å; Y321-R341 VanDerWaalsContact CE2-NH2 3.33Å; Y321-R341 PolarHBondContact OH-NH1 3.39Å; Y321-R341 PolarHBondContact OH-NH2 2.73Å; Y321-I453 VanDerWaalsContact OH-CD1 3.29Å; Y321-I453 WeakPolarHBondContact OH-CD1 3.33Å; Y321-I453 WeakPolarHBondContact OH-CG1 3.48Å
322	Q	27.2	Very low	29.3	Very low	162 Å²	162	111.4 Å²	111.4	76%	0.757	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	18	-176.4	-68.4	-175	-27.3	0	0	114.3	N320 G324	N320-Q322 PolarHBondContact OD1-N 2.97Å; N320-Q322 VanDerWaalsContact OD1-N 3.11Å; Q322-G324 PolarHBondContact O-N 3.32Å
323	I	33.3	Very low	29.2	Very low	132 Å²	132	109.9 Å²	109.9	68%	0.677	60%	0.595	S	S	*	*			trans	-79.2	55.7	172.8	-44.4	-176.1	0	0	0	110.5	N320 S325	N320-I323 HydrophobicContact CB-CD1 4.26Å; N320-I323 HydrophobicContact CB-CG1 4.19Å; I323-S325 PolarHBondContact O-N 3.27Å
324	G	27.8	Very low	29.4	Very low	62 Å²	62	114.9 Å²	114.9	64%	0.639	61%	0.606	S	S	*	*			trans	-80.9	91.1	165.9	0	0	0	0	0	109.5	Q322	Q322-G324 PolarHBondContact O-N 3.32Å
325	S	33	Very low	29.3	Very low	101 Å²	101	113.3 Å²	113.3	71%	0.706	60%	0.602	S	S	*	*	S	Bend	trans	65.1	156	177.2	57	0	0	0	0	117.5	I323	I323-S325 PolarHBondContact O-N 3.27Å
326	E	25.2	Very low	29.3	Very low	162 Å²	162	115.2 Å²	115.2	76%	0.757	62%	0.618	S	S	*	*	S	Bend	trans	63.3	94.1	166.6	-58.9	-171.1	-170.7	0	0	120.2	T328	E326-T328 PolarHBondContact O-N 2.75Å
327	N	30.4	Very low	29.4	Very low	174 Å²	174	118.5 Å²	118.5	93%	0.93	63%	0.631	S	S	*	*				41.3	50.7	127.8	-65.2	-20.5	0	0	0	119.4
328	T	23	Very low	29.5	Very low	117 Å²	117	120.9 Å²	120.9	72%	0.718	65%	0.648	S	S	*	*			trans	-108.4	134.1	164.3	34.3	0	0	0	0	111.8	E326	E326-T328 PolarHBondContact O-N 2.75Å
329	P	26.6	Very low	30.4	Very low	108 Å²	108	121.8 Å²	121.8	70%	0.701	65%	0.652	S	S	*	*			trans	-72.8	146.4	-179.2	29	-34.2	0	0	0	112.2	F331	P329-F331 PolarHBondContact O-N 3.22Å
330	I	32.4	Very low	31.4	Very low	156 Å²	156	122.8 Å²	122.8	80%	0.8	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	5.2	-163.3	-67.9	163.5	0	0	0	115.6
331	F	25.6	Very low	32.8	Very low	157 Å²	157	122.7 Å²	122.7	69%	0.689	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-14.1	-170.7	-79.1	-84.4	0	0	0	116.5	P329	P329-F331 PolarHBondContact O-N 3.22Å
332	N	24.9	Very low	34.4	Very low	157 Å²	157	117.8 Å²	117.8	84%	0.84	63%	0.632	S	S	*	*	S	Bend	trans	-107	24.5	-165.3	-100.4	24.2	0	0	0	116.8
333	Q	29.2	Very low	36.6	Very low	97 Å²	97	110.1 Å²	110.1	45%	0.453	60%	0.596	S	S	.	*			trans	-132	78.8	168.9	-68.4	-163.5	9.1	0	0	113.1	N320	N320-Q333 PolarHBondContact ND2-OE1 3.29Å
334	R	33.4	Very low	39	Very low	202 Å²	202	104.8 Å²	104.8	76%	0.762	57%	0.568	S	S	*	*			trans	-109.3	67.1	149.7	-76.1	-173.8	172.7	-172.6	-3.9	108.8
335	S	30.1	Very low	41.8	Very low	57 Å²	57	101.9 Å²	101.9	40%	0.399	54%	0.538	S	S	.	.			trans	-65	157.2	163.4	47.6	0	0	0	0	109.7	D337 C338	S335-D337 PolarHBondContact O-N 3.16Å; S335-D337 VanDerWaalsContact O-N 3.15Å; S335-C338 PolarHBondContact OG-SG 3.39Å; S335-C338 VanDerWaalsContact OG-SG 3.33Å
336	T	33.1	Very low	44.5	Very low	130 Å²	130	97.1 Å²	97.1	80%	0.798	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.7	-176	31.6	0	0	0	0	114.3
337	D	31.3	Very low	47.4	Very low	129 Å²	129	89.4 Å²	89.4	69%	0.69	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	3.8	-162.9	-52.4	-80.3	0	0	0	113.9	S335 M339	S335-D337 PolarHBondContact O-N 3.16Å; S335-D337 VanDerWaalsContact O-N 3.15Å; D337-M339 VanDerWaalsContact C-N 3.28Å; D337-M339 PolarHBondContact O-N 3.16Å
338	C	38.1	Very low	50	Low	70 Å²	70	81.2 Å²	81.2	47%	0.473	43%	0.425	S	S	.	.			trans	-69.4	78.4	176	-77	0	0	0	0	112.3	S335 L340	S335-C338 PolarHBondContact OG-SG 3.39Å; S335-C338 VanDerWaalsContact OG-SG 3.33Å; C338-L340 PolarHBondContact O-N 3.44Å
339	M	46.3	Very low	52.9	Low	136 Å²	136	75.7 Å²	75.7	67%	0.67	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-59.5	121.5	166.8	-72.6	-77	-177.1	0	0	110.3	D337 R341	D337-M339 VanDerWaalsContact C-N 3.28Å; D337-M339 PolarHBondContact O-N 3.16Å; M339-R341 PolarHBondContact O-N 2.74Å
340	L	51.1	Low	55.6	Low	80 Å²	80	70.7 Å²	70.7	42%	0.419	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.4	171.2	-65.2	172.1	0	0	0	109.9	C338 D379	C338-L340 PolarHBondContact O-N 3.44Å; L340-D379 WeakPolarHBondContact CD1-O 3.41Å
341	R	56.3	Low	57.9	Low	56 Å²	56	63.4 Å²	63.4	21%	0.211	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-68.1	135.7	178.9	-79	177	166.6	-136.7	2.1	110.3	Y321 M339 H437 V439 N451	Y321-R341 VanDerWaalsContact CE2-CZ 3.43Å; Y321-R341 VanDerWaalsContact CE2-NH2 3.33Å; Y321-R341 PolarHBondContact OH-NH1 3.39Å; Y321-R341 PolarHBondContact OH-NH2 2.73Å; M339-R341 PolarHBondContact O-N 2.74Å; R341-H437 WeakPolarHBondContact CD-O 3.3Å; R341-H437 WeakPolarHBondContact CG-O 3.49Å; R341-H437 PolarHBondContact NE-O 3.38Å; R341-H437 VanDerWaalsContact NE-O 3.11Å; R341-H437 PolarHBondContact NH1-O 3.24Å; R341-V439 HydrophobicContact CB-CG2 4.21Å; R341-N451 PolarHBondContact NH1-O 3.18Å
342	P	64.6	Low	60.4	Low	28 Å²	28	57 Å²	57	18%	0.182	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-63.5	144.8	174.7	24.6	-32.6	0	0	0	111.4	F344 Q382 V436 G438 V439	P342-F344 HydrophobicContact CB-CE2 3.79Å; P342-F344 HydrophobicContact CB-CZ 4.13Å; P342-F344 HydrophobicContact CG-CE2 3.85Å; P342-F344 HydrophobicContact CG-CZ 4.26Å; P342-Q382 CarbonylContact C-O 3.59Å; P342-Q382 VanDerWaalsContact CA-O 3.27Å; P342-Q382 WeakPolarHBondContact CA-O 3.26Å; P342-Q382 HydrophobicContact CB-CB 4.31Å; P342-V436 HydrophobicContact CG-CB 4.4Å; P342-V436 HydrophobicContact CG-CG2 3.55Å; P342-G438 CarbonylContact O-C 3.5Å; P342-G438 WeakPolarHBondContact O-CA 3.42Å; P342-V439 PolarHBondContact O-N 2.85Å
343	V	72.3	Confident	62.7	Low	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.3	-171	-179.3	0	0	0	0	110	L317 I345 F376 C381 Q382 T383 V384 V439 V441	L317-V343 HydrophobicContact CD1-CG2 4.46Å; V343-I345 HydrophobicContact CG1-CD1 4.44Å; V343-I345 HydrophobicContact CG1-CG1 4Å; V343-F376 HydrophobicContact CG1-CB 4.35Å; V343-F376 HydrophobicContact CG1-CD1 4.05Å; V343-F376 HydrophobicContact CG1-CD2 4Å; V343-F376 HydrophobicContact CG1-CE1 4.35Å; V343-F376 HydrophobicContact CG1-CE2 4.29Å; V343-F376 HydrophobicContact CG1-CG 3.87Å; V343-F376 HydrophobicContact CG1-CZ 4.46Å; V343-F376 HydrophobicContact CG2-CB 4.44Å; V343-F376 HydrophobicContact CG2-CD1 4.29Å; V343-F376 HydrophobicContact CG2-CG 4.48Å; V343-C381 HydrophobicContact CG2-CB 3.64Å; V343-Q382 PolarHBondContact N-O 3.42Å; V343-T383 HydrophobicContact CB-CG2 4.21Å; V343-T383 HydrophobicContact CG1-CG2 4.25Å; V343-T383 WeakPolarHBondContact O-CA 3.36Å; V343-V384 PolarHBondContact O-N 2.95Å; V343-V439 HydrophobicContact CB-CB 4.5Å; V343-V439 HydrophobicContact CG1-CB 4.46Å; V343-V439 HydrophobicContact CG2-CB 4.08Å; V343-V439 HydrophobicContact CG2-CG2 4.23Å; V343-V441 HydrophobicContact CG1-CG2 3.5Å
344	F	84.8	Confident	64.7	Low	20 Å²	20	47.3 Å²	47.3	9%	0.088	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.8	-176.7	-59	-99.4	0	0	0	108.7	P342 Y386 V429 E432 A433 V436 V439 V441	P342-F344 HydrophobicContact CB-CE2 3.79Å; P342-F344 HydrophobicContact CB-CZ 4.13Å; P342-F344 HydrophobicContact CG-CE2 3.85Å; P342-F344 HydrophobicContact CG-CZ 4.26Å; F344-Y386 HydrophobicContact CB-CE2 4.19Å; F344-Y386 AromaticContact CD1-CE2 3.64Å; F344-Y386 HydrophobicContact CD1-CE2 3.64Å; F344-Y386 AromaticContact CD1-CZ 3.97Å; F344-Y386 HydrophobicContact CG-CE2 4.4Å; F344-V429 VanDerWaalsContact C-CG1 3.41Å; F344-V429 HydrophobicContact CB-CG1 3.59Å; F344-V429 WeakPolarHBondContact O-CG1 3.44Å; F344-E432 HydrophobicContact CD1-CB 3.59Å; F344-E432 HydrophobicContact CE1-CB 3.54Å; F344-E432 HydrophobicContact CZ-CB 4.4Å; F344-A433 HydrophobicContact CB-CB 4.16Å; F344-A433 HydrophobicContact CD2-CB 3.78Å; F344-A433 HydrophobicContact CE2-CB 4.47Å; F344-A433 HydrophobicContact CG-CB 4.07Å; F344-V436 HydrophobicContact CE2-CG2 3.49Å; F344-V436 VanDerWaalsContact CE2-CG2 3.49Å; F344-V436 HydrophobicContact CZ-CG2 3.52Å; F344-V439 PolarHBondContact N-O 3.11Å; F344-V441 PolarHBondContact O-N 2.64Å
345	I	87.3	Confident	66.3	Low	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.1	-170	-52.6	168.7	0	0	0	110.8	V343 G347 I372 F376 T383 V384 I385 Y386 V441	V343-I345 HydrophobicContact CG1-CD1 4.44Å; V343-I345 HydrophobicContact CG1-CG1 4Å; I345-G347 PolarHBondContact O-N 2.92Å; I345-G347 VanDerWaalsContact O-N 3.11Å; I345-I372 HydrophobicContact CD1-CG1 4.25Å; I345-I372 HydrophobicContact CG2-CD1 4.03Å; I345-F376 HydrophobicContact CD1-CD2 3.76Å; I345-F376 HydrophobicContact CD1-CE2 4.02Å; I345-F376 HydrophobicContact CG1-CD2 4.49Å; I345-F376 HydrophobicContact CG1-CE2 4.44Å; I345-T383 HydrophobicContact CD1-CG2 3.5Å; I345-T383 VanDerWaalsContact CD1-CG2 3.5Å; I345-T383 HydrophobicContact CG1-CG2 4.31Å; I345-V384 PolarHBondContact N-O 3.07Å; I345-I385 HydrophobicContact CB-CG1 3.96Å; I345-I385 HydrophobicContact CD1-CG1 3.84Å; I345-I385 HydrophobicContact CG1-CG1 4.44Å; I345-I385 HydrophobicContact CG2-CG1 4.23Å; I345-Y386 PolarHBondContact O-N 3.22Å; I345-V441 HydrophobicContact CB-CB 4.31Å; I345-V441 HydrophobicContact CG1-CB 4Å; I345-V441 HydrophobicContact CG1-CG1 4.49Å; I345-V441 HydrophobicContact CG1-CG2 4.12Å; I345-V441 HydrophobicContact CG2-CB 4.32Å; I345-V441 HydrophobicContact CG2-CG1 4.34Å
346	D	88.5	Confident	67.5	Low	1 Å²	1	43 Å²	43	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	96.3	165.3	-176.7	-19.7	0	0	0	109.3	L348 S349 F350 V429 V441 S442	D346-L348 VanDerWaalsContact C-N 3.27Å; D346-L348 PolarHBondContact O-N 3.14Å; D346-L348 WeakPolarHBondContact OD1-CB 3.45Å; D346-L348 PolarHBondContact OD1-N 3.42Å; D346-L348 VanDerWaalsContact OD1-N 3.09Å; D346-S349 VanDerWaalsContact CG-CB 3.46Å; D346-S349 PolarHBondContact O-N 3.49Å; D346-S349 PolarHBondContact OD1-N 2.81Å; D346-F350 PolarHBondContact O-N 3.5Å; D346-F350 VanDerWaalsContact O-N 3.07Å; D346-V429 HydrophobicContact CB-CG2 4.15Å; D346-V441 PolarHBondContact N-O 2.76Å; D346-S442 PolarHBondContact OD2-OG 2.91Å
347	G	87.1	Confident	68.6	Low	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-30.5	-178.1	0	0	0	0	0	113.2	I345 M351 Y386	I345-G347 PolarHBondContact O-N 2.92Å; I345-G347 VanDerWaalsContact O-N 3.11Å; G347-M351 VanDerWaalsContact O-CG 3.27Å; G347-M351 WeakPolarHBondContact O-CG 3.36Å; G347-M351 PolarHBondContact O-N 3.49Å; G347-Y386 PolarHBondContact N-O 2.71Å
348	L	84.9	Confident	69.4	Low	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-46.4	175.5	-71.6	179.6	0	0	0	111.2	D346 F350 M351 D352 L361 P388 Y391 V425	D346-L348 VanDerWaalsContact C-N 3.27Å; D346-L348 PolarHBondContact O-N 3.14Å; D346-L348 WeakPolarHBondContact OD1-CB 3.45Å; D346-L348 PolarHBondContact OD1-N 3.42Å; D346-L348 VanDerWaalsContact OD1-N 3.09Å; L348-F350 VanDerWaalsContact C-N 3.28Å; L348-F350 PolarHBondContact O-N 3.14Å; L348-M351 PolarHBondContact O-N 3.4Å; L348-D352 PolarHBondContact O-N 2.83Å; L348-L361 HydrophobicContact CD1-CD2 4.45Å; L348-L361 HydrophobicContact CD2-CD2 4.11Å; L348-P388 HydrophobicContact CD1-CG 4.04Å; L348-P388 HydrophobicContact CD2-CG 4.28Å; L348-P388 HydrophobicContact CG-CG 4.41Å; L348-Y391 HydrophobicContact CD2-CE2 4.01Å; L348-V425 HydrophobicContact CD1-CB 4.39Å; L348-V425 HydrophobicContact CD1-CG2 4Å
349	S	83.6	Confident	70.1	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-37.8	178.6	-150.9	0	0	0	0	111.9	D346 S442 S443	D346-S349 VanDerWaalsContact CG-CB 3.46Å; D346-S349 PolarHBondContact O-N 3.49Å; D346-S349 PolarHBondContact OD1-N 2.81Å; S349-S442 VanDerWaalsContact CB-OG 3.28Å; S349-S442 WeakPolarHBondContact CB-OG 3.36Å; S349-S442 PolarHBondContact OG-OG 3.06Å; S349-S442 VanDerWaalsContact OG-OG 3.14Å; S349-S443 PolarHBondContact O-OG 3.47Å; S349-S443 VanDerWaalsContact O-OG 3.11Å; S349-S443 PolarHBondContact OG-N 3.11Å; S349-S443 PolarHBondContact OG-OG 2.84Å
350	F	82.1	Confident	70.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.009	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-46.9	172.9	176.9	-106.9	0	0	0	113.3	D346 L348 D352 M353 L354 S368 I372 P457 I459 F469 I471	D346-F350 PolarHBondContact O-N 3.5Å; D346-F350 VanDerWaalsContact O-N 3.07Å; L348-F350 VanDerWaalsContact C-N 3.28Å; L348-F350 PolarHBondContact O-N 3.14Å; F350-D352 VanDerWaalsContact C-N 3.33Å; F350-D352 PolarHBondContact O-N 3.38Å; F350-M353 HydrophobicContact CD2-CE 3.84Å; F350-M353 WeakPolarHBondContact O-CB 3.37Å; F350-M353 PolarHBondContact O-N 2.88Å; F350-L354 HydrophobicContact CD1-CD1 4.28Å; F350-L354 HydrophobicContact CE1-CD1 3.65Å; F350-L354 HydrophobicContact CZ-CD1 3.81Å; F350-S368 VanDerWaalsContact CE1-O 3.32Å; F350-S368 WeakPolarHBondContact CE1-O 3.22Å; F350-I372 HydrophobicContact CB-CD1 4.31Å; F350-I372 HydrophobicContact CD1-CB 4.39Å; F350-I372 HydrophobicContact CD1-CD1 4.37Å; F350-I372 HydrophobicContact CD1-CG2 3.81Å; F350-I372 HydrophobicContact CD2-CB 4.39Å; F350-I372 HydrophobicContact CD2-CD1 3.36Å; F350-I372 HydrophobicContact CD2-CG1 4.41Å; F350-I372 HydrophobicContact CE1-CB 3.97Å; F350-I372 HydrophobicContact CE1-CG2 3.63Å; F350-I372 HydrophobicContact CE2-CB 3.97Å; F350-I372 HydrophobicContact CE2-CD1 3.66Å; F350-I372 HydrophobicContact CE2-CG1 4.3Å; F350-I372 HydrophobicContact CE2-CG2 4.43Å; F350-I372 HydrophobicContact CG-CD1 3.75Å; F350-I372 HydrophobicContact CG-CG2 4.28Å; F350-I372 HydrophobicContact CZ-CB 3.74Å; F350-I372 HydrophobicContact CZ-CD1 4.29Å; F350-I372 HydrophobicContact CZ-CG2 3.96Å; F350-P457 HydrophobicContact CD2-CB 4.39Å; F350-P457 HydrophobicContact CD2-CG 4.33Å; F350-I459 HydrophobicContact CD2-CD1 4.02Å; F350-I459 HydrophobicContact CE2-CD1 3.56Å; F350-I459 HydrophobicContact CE2-CG1 4.29Å; F350-I459 HydrophobicContact CZ-CD1 4.22Å; F350-F469 HydrophobicContact CZ-CE2 4.34Å; F350-F469 HydrophobicContact CZ-CZ 4.47Å; F350-I471 HydrophobicContact CE2-CD1 4.05Å; F350-I471 HydrophobicContact CZ-CD1 4.04Å
351	M	81.8	Confident	71.9	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.015	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-30.8	-178.8	-68.9	-54	-51.1	0	0	113.2	G347 L348 M353 L354 I355 P362 I364 L369	G347-M351 VanDerWaalsContact O-CG 3.27Å; G347-M351 WeakPolarHBondContact O-CG 3.36Å; G347-M351 PolarHBondContact O-N 3.49Å; L348-M351 PolarHBondContact O-N 3.4Å; M351-M353 VanDerWaalsContact C-N 3.32Å; M351-M353 PolarHBondContact O-N 3.16Å; M351-L354 HydrophobicContact CE-CD1 4.02Å; M351-L354 WeakPolarHBondContact O-CA 3.41Å; M351-L354 WeakPolarHBondContact O-CB 3.47Å; M351-L354 PolarHBondContact O-N 3.35Å; M351-L354 HydrophobicContact SD-CD1 4.01Å; M351-I355 PolarHBondContact O-N 3.3Å; M351-P362 HydrophobicContact CB-CG 4.26Å; M351-I364 HydrophobicContact CG-CG1 4.49Å; M351-L369 HydrophobicContact CG-CD2 4.15Å; M351-L369 HydrophobicContact SD-CD2 3.8Å
352	D	77.8	Confident	72.7	Confident	22 Å²	22	38 Å²	38	12%	0.118	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-29.5	175.4	-84.7	27.9	0	0	0	113.1	L348 F350 L354 I355 I357 R422	L348-D352 PolarHBondContact O-N 2.83Å; F350-D352 VanDerWaalsContact C-N 3.33Å; F350-D352 PolarHBondContact O-N 3.38Å; D352-L354 PolarHBondContact O-N 3.48Å; D352-I355 CarbonylContact O-C 3.6Å; D352-I355 PolarHBondContact O-N 3.34Å; D352-I357 HydrophobicContact CB-CG1 4.44Å; D352-I357 WeakPolarHBondContact OD2-CD1 3.28Å; D352-I357 WeakPolarHBondContact OD2-CG1 3.5Å; D352-R422 IonicContact OD1-NH1 2.66Å; D352-R422 IonicContact OD2-CZ 2.66Å; D352-R422 IonicContact OD2-NH1 2.6Å; D352-R422 PolarHBondContact OD2-NH1 3.21Å; D352-R422 IonicContact OD2-NH2 2.82Å; D352-R422 PolarHBondContact OD2-NH2 3.3Å
353	M	73.6	Confident	73.4	Confident	49 Å²	49	41.8 Å²	41.8	24%	0.241	25%	0.249	C	C	.	.	H	α-helix	trans	-66.9	-21.3	170.5	-67.8	-168.6	-73.1	0	0	112.8	F350 M351 S443 P457 I459 R461	F350-M353 HydrophobicContact CD2-CE 3.84Å; F350-M353 WeakPolarHBondContact O-CB 3.37Å; F350-M353 PolarHBondContact O-N 2.88Å; M351-M353 VanDerWaalsContact C-N 3.32Å; M351-M353 PolarHBondContact O-N 3.16Å; M353-S443 WeakPolarHBondContact SD-CB 3.33Å; M353-P457 HydrophobicContact CE-CB 3.97Å; M353-P457 HydrophobicContact CE-CG 3.89Å; M353-P457 VanDerWaalsContact CE-O 3.22Å; M353-P457 WeakPolarHBondContact CE-O 3.43Å; M353-I459 HydrophobicContact CB-CD1 3.6Å; M353-I459 HydrophobicContact CB-CG1 4.2Å; M353-I459 HydrophobicContact CE-CD1 4.02Å; M353-I459 HydrophobicContact CE-CG1 4.12Å; M353-I459 HydrophobicContact SD-CD1 4.47Å; M353-I459 HydrophobicContact SD-CG1 4.29Å; M353-R461 PolarHBondContact O-NH2 2.96Å
354	L	71.3	Confident	73.7	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-90.6	-32.1	176.9	-68.3	165.2	0	0	0	112.4	F350 M351 D352 S368 I459 R461 L466 F469	F350-L354 HydrophobicContact CD1-CD1 4.28Å; F350-L354 HydrophobicContact CE1-CD1 3.65Å; F350-L354 HydrophobicContact CZ-CD1 3.81Å; M351-L354 HydrophobicContact CE-CD1 4.02Å; M351-L354 WeakPolarHBondContact O-CA 3.41Å; M351-L354 WeakPolarHBondContact O-CB 3.47Å; M351-L354 PolarHBondContact O-N 3.35Å; M351-L354 HydrophobicContact SD-CD1 4.01Å; D352-L354 PolarHBondContact O-N 3.48Å; L354-S368 WeakPolarHBondContact CD1-OG 3.48Å; L354-I459 HydrophobicContact CD1-CD1 4.37Å; L354-I459 HydrophobicContact CD2-CD1 3.74Å; L354-I459 HydrophobicContact CD2-CG2 4.01Å; L354-I459 HydrophobicContact CG-CD1 3.67Å; L354-R461 VanDerWaalsContact CA-NH2 3.32Å; L354-R461 VanDerWaalsContact O-CZ 3.24Å; L354-R461 PolarHBondContact O-NH1 3.32Å; L354-R461 PolarHBondContact O-NH2 3.21Å; L354-L466 WeakPolarHBondContact O-CD2 3.13Å; L354-F469 HydrophobicContact CD1-CE1 4.49Å; L354-F469 HydrophobicContact CD1-CZ 4.24Å; L354-F469 HydrophobicContact CD2-CD1 3.7Å; L354-F469 HydrophobicContact CD2-CD2 4.3Å; L354-F469 HydrophobicContact CD2-CE1 3.56Å; L354-F469 HydrophobicContact CD2-CE2 4.16Å; L354-F469 HydrophobicContact CD2-CG 4.08Å; L354-F469 HydrophobicContact CD2-CZ 3.81Å
355	I	67.3	Low	73.3	Confident	58 Å²	58	42.2 Å²	42.2	30%	0.297	26%	0.255	S	S	.	.	S	Bend	trans	-126.1	100.4	-178.8	-53.8	-179.7	0	0	0	110.1	M351 D352 I357 P362	M351-I355 PolarHBondContact O-N 3.3Å; D352-I355 CarbonylContact O-C 3.6Å; D352-I355 PolarHBondContact O-N 3.34Å; I355-I357 PolarHBondContact O-N 3.39Å; I355-P362 HydrophobicContact CD1-CB 4.32Å
356	P	55.4	Low	72.4	Confident	109 Å²	109	42.2 Å²	42.2	71%	0.708	26%	0.255	S	S	*	.			trans	-54.5	126.6	174.2	-26.4	35.7	0	0	0	111.8
357	I	55.8	Low	71.2	Confident	118 Å²	118	47 Å²	47	61%	0.605	27%	0.273	S	S	*	.			trans	-66	131.3	-159.4	-55.3	167.3	0	0	0	112.6	D352 I355	D352-I357 HydrophobicContact CB-CG1 4.44Å; D352-I357 WeakPolarHBondContact OD2-CD1 3.28Å; D352-I357 WeakPolarHBondContact OD2-CG1 3.5Å; I355-I357 PolarHBondContact O-N 3.39Å
358	S	48.3	Very low	70.3	Confident	92 Å²	92	47.1 Å²	47.1	64%	0.643	27%	0.274	S	S	*	.			trans	-110.2	154.3	138.2	68.8	0	0	0	0	107.8	S360	S358-S360 PolarHBondContact O-N 3.09Å
359	S	52.2	Low	69.6	Low	131 Å²	131	47 Å²	47	92%	0.916	27%	0.273	S	S	*	.	S	Bend	trans	-70.8	26.4	-152.4	60.9	0	0	0	0	118.2
360	S	62.7	Low	68.6	Low	85 Å²	85	49.6 Å²	49.6	59%	0.594	29%	0.286	S	S	*	.	S	Bend	trans	-109	154.2	172.5	53.1	0	0	0	0	110.9	S358	S358-S360 PolarHBondContact O-N 3.09Å
361	L	71.4	Confident	67.5	Low	53 Å²	53	51.9 Å²	51.9	28%	0.277	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-56.2	135.2	169.4	-71.9	171.2	0	0	0	110.3	L348 Y390	L348-L361 HydrophobicContact CD1-CD2 4.45Å; L348-L361 HydrophobicContact CD2-CD2 4.11Å; L361-Y390 HydrophobicContact CB-CD1 4.33Å; L361-Y390 HydrophobicContact CB-CE1 4.06Å; L361-Y390 HydrophobicContact CD1-CD1 3.48Å; L361-Y390 VanDerWaalsContact CD1-CD1 3.48Å; L361-Y390 HydrophobicContact CD1-CD2 4.02Å; L361-Y390 HydrophobicContact CD1-CE1 3.86Å; L361-Y390 HydrophobicContact CD1-CE2 4.37Å; L361-Y390 HydrophobicContact CD1-CG 3.55Å
362	P	73.9	Confident	66.7	Low	19 Å²	19	51.8 Å²	51.8	12%	0.123	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.9	154	-174.1	27.9	-35.1	0	0	0	112.4	M351 I355 I364 Y391	M351-P362 HydrophobicContact CB-CG 4.26Å; I355-P362 HydrophobicContact CD1-CB 4.32Å; P362-I364 PolarHBondContact O-N 3.04Å; P362-Y391 WeakPolarHBondContact CD-OH 3.46Å; P362-Y391 WeakPolarHBondContact O-CE1 3.5Å; P362-Y391 PolarHBondContact O-OH 3.24Å
363	I	78.8	Confident	65.8	Low	106 Å²	106	50.9 Å²	50.9	54%	0.544	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-71.1	122.3	161.1	-60.7	177	0	0	0	107.1	K398	I363-K398 WeakPolarHBondContact CA-O 3.45Å
364	I	78.9	Confident	64.9	Low	1 Å²	1	52.5 Å²	52.5	1%	0.005	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-75.6	130.2	-178.9	-70.5	-179.2	0	0	0	109.8	M351 P362 L369 L387 Y391 K398 V399 D400 F405	M351-I364 HydrophobicContact CG-CG1 4.49Å; P362-I364 PolarHBondContact O-N 3.04Å; I364-L369 HydrophobicContact CG2-CD1 3.51Å; I364-L369 HydrophobicContact CG2-CD2 4.32Å; I364-L369 HydrophobicContact CG2-CG 3.78Å; I364-L387 HydrophobicContact CD1-CD1 3.63Å; I364-L387 HydrophobicContact CD1-CD2 3.83Å; I364-L387 HydrophobicContact CD1-CG 4.38Å; I364-Y391 HydrophobicContact CD1-CD1 3.52Å; I364-Y391 HydrophobicContact CD1-CD2 3.93Å; I364-Y391 HydrophobicContact CD1-CE1 3.49Å; I364-Y391 VanDerWaalsContact CD1-CE1 3.49Å; I364-Y391 HydrophobicContact CD1-CE2 3.89Å; I364-Y391 HydrophobicContact CD1-CG 3.74Å; I364-Y391 HydrophobicContact CG1-CD1 4.07Å; I364-Y391 HydrophobicContact CG1-CE1 3.61Å; I364-K398 PolarHBondContact N-O 3.05Å; I364-V399 HydrophobicContact CB-CG1 4.33Å; I364-V399 HydrophobicContact CB-CG2 4.33Å; I364-V399 HydrophobicContact CG2-CG1 4.23Å; I364-V399 WeakPolarHBondContact O-CA 3.39Å; I364-D400 PolarHBondContact O-N 3.03Å; I364-F405 HydrophobicContact CD1-CE2 4.28Å; I364-F405 HydrophobicContact CG2-CE2 4.4Å
365	S	76.3	Confident	64.4	Low	29 Å²	29	53.5 Å²	53.5	20%	0.203	31%	0.306	C	S	.	.			trans	-90.8	115.7	161.5	-173.2	0	0	0	0	110.3	R367 S368 L369 D400	S365-R367 PolarHBondContact O-N 3.07Å; S365-S368 WeakPolarHBondContact O-CB 3.4Å; S365-S368 PolarHBondContact O-N 3.25Å; S365-S368 VanDerWaalsContact O-N 3.08Å; S365-L369 PolarHBondContact O-N 3.18Å; S365-D400 VanDerWaalsContact CA-OD2 3.28Å; S365-D400 WeakPolarHBondContact CA-OD2 3.33Å; S365-D400 WeakPolarHBondContact CB-OD2 3.47Å; S365-D400 PolarHBondContact OG-OD2 3.26Å
366	T	69.1	Low	63.9	Low	1 Å²	1	50.7 Å²	50.7	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-66.8	-28.7	-178.7	-36.7	0	0	0	0	111.1	L369 L370 V399 D400 D401 I404 F405 L408	T366-L369 PolarHBondContact O-N 3.47Å; T366-L370 WeakPolarHBondContact O-CG 3.44Å; T366-L370 PolarHBondContact O-N 3.37Å; T366-V399 WeakPolarHBondContact OG1-CG1 3.43Å; T366-D400 VanDerWaalsContact CB-OD1 3.31Å; T366-D400 WeakPolarHBondContact CB-OD1 3.46Å; T366-D400 PolarHBondContact N-OD1 3.17Å; T366-D400 PolarHBondContact OG1-OD1 3.45Å; T366-D401 PolarHBondContact OG1-O 3.09Å; T366-I404 HydrophobicContact CG2-CB 3.84Å; T366-I404 HydrophobicContact CG2-CG2 3.5Å; T366-I404 VanDerWaalsContact CG2-CG2 3.5Å; T366-F405 HydrophobicContact CG2-CB 4.07Å; T366-L408 HydrophobicContact CG2-CD1 4.07Å
367	R	63.4	Low	63.8	Low	102 Å²	102	48.7 Å²	48.7	39%	0.385	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-44.1	170.6	178.1	172.2	172.4	-147.1	-23.7	111.4	S365 L370 E371 D467	S365-R367 PolarHBondContact O-N 3.07Å; R367-L370 WeakPolarHBondContact O-CB 3.25Å; R367-L370 PolarHBondContact O-N 3.1Å; R367-E371 IonicContact CZ-OE1 2.67Å; R367-E371 IonicContact NE-OE1 3.99Å; R367-E371 PolarHBondContact NE-OE1 2.78Å; R367-E371 IonicContact NH2-OE1 3.69Å; R367-E371 PolarHBondContact NH2-OE1 3.41Å; R367-E371 WeakPolarHBondContact O-CG 3.39Å; R367-E371 PolarHBondContact O-N 3.42Å; R367-D467 IonicContact CZ-OD2 2.75Å; R367-D467 PolarHBondContact NH1-O 2.89Å; R367-D467 IonicContact NH1-OD2 3.81Å; R367-D467 PolarHBondContact NH1-OD2 3.07Å; R367-D467 PolarHBondContact NH2-O 3.09Å
368	S	68.6	Low	63.3	Low	3 Å²	3	49.7 Å²	49.7	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-38.4	177.9	-57.2	0	0	0	0	112.2	F350 L354 S365 E371 I372	F350-S368 VanDerWaalsContact CE1-O 3.32Å; F350-S368 WeakPolarHBondContact CE1-O 3.22Å; L354-S368 WeakPolarHBondContact CD1-OG 3.48Å; S365-S368 WeakPolarHBondContact O-CB 3.4Å; S365-S368 PolarHBondContact O-N 3.25Å; S365-S368 VanDerWaalsContact O-N 3.08Å; S368-E371 PolarHBondContact O-N 2.93Å; S368-I372 PolarHBondContact O-N 3.32Å; S368-I372 VanDerWaalsContact O-N 3.13Å
369	L	70.4	Confident	63.2	Low	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-42.2	172.4	-60.8	-169.1	0	0	0	111.9	M351 I364 S365 T366 I372 L373 I385 L387 F405 I414	M351-L369 HydrophobicContact CG-CD2 4.15Å; M351-L369 HydrophobicContact SD-CD2 3.8Å; I364-L369 HydrophobicContact CG2-CD1 3.51Å; I364-L369 HydrophobicContact CG2-CD2 4.32Å; I364-L369 HydrophobicContact CG2-CG 3.78Å; S365-L369 PolarHBondContact O-N 3.18Å; T366-L369 PolarHBondContact O-N 3.47Å; L369-I372 WeakPolarHBondContact O-CG2 3.4Å; L369-L373 WeakPolarHBondContact O-CB 3.17Å; L369-L373 VanDerWaalsContact O-CG 3.29Å; L369-L373 WeakPolarHBondContact O-CG 3.28Å; L369-L373 PolarHBondContact O-N 2.6Å; L369-I385 HydrophobicContact CB-CD1 4.11Å; L369-I385 HydrophobicContact CD2-CD1 4.12Å; L369-L387 HydrophobicContact CD1-CD1 4.31Å; L369-F405 HydrophobicContact CD1-CD2 4.2Å; L369-F405 HydrophobicContact CD1-CE2 4.03Å; L369-I414 HydrophobicContact CD1-CD1 3.98Å
370	L	60.9	Low	62.9	Low	55 Å²	55	43.5 Å²	43.5	29%	0.288	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-42.3	173.9	-77.6	172.5	0	0	0	112.2	T366 R367 L373 L374 I404 L408	T366-L370 WeakPolarHBondContact O-CG 3.44Å; T366-L370 PolarHBondContact O-N 3.37Å; R367-L370 WeakPolarHBondContact O-CB 3.25Å; R367-L370 PolarHBondContact O-N 3.1Å; L370-L373 PolarHBondContact O-N 3.26Å; L370-L374 WeakPolarHBondContact O-CB 3.17Å; L370-L374 VanDerWaalsContact O-CG 3.23Å; L370-L374 WeakPolarHBondContact O-CG 3.26Å; L370-L374 PolarHBondContact O-N 3.1Å; L370-I404 HydrophobicContact CD1-CG2 3.79Å; L370-I404 HydrophobicContact CG-CG2 4.33Å; L370-L408 HydrophobicContact CD2-CD1 4.25Å; L370-L408 HydrophobicContact CD2-CD2 3.95Å; L370-L408 HydrophobicContact CG-CD1 4.42Å
371	E	60.6	Low	62.4	Low	51 Å²	51	39.8 Å²	39.8	24%	0.238	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-40	-178.5	-76.2	169.2	173.8	0	0	112.1	R367 S368 N375 F469 I471	R367-E371 IonicContact CZ-OE1 2.67Å; R367-E371 IonicContact NE-OE1 3.99Å; R367-E371 PolarHBondContact NE-OE1 2.78Å; R367-E371 IonicContact NH2-OE1 3.69Å; R367-E371 PolarHBondContact NH2-OE1 3.41Å; R367-E371 WeakPolarHBondContact O-CG 3.39Å; R367-E371 PolarHBondContact O-N 3.42Å; S368-E371 PolarHBondContact O-N 2.93Å; E371-N375 WeakPolarHBondContact O-CB 3.44Å; E371-N375 PolarHBondContact O-N 2.85Å; E371-N375 VanDerWaalsContact O-N 3.17Å; E371-F469 WeakPolarHBondContact OE2-CE1 3.32Å; E371-F469 WeakPolarHBondContact OE2-CZ 3.34Å; E371-I471 HydrophobicContact CB-CD1 4.47Å
372	I	64.5	Low	61.9	Low	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-76.1	-31.7	172.6	-166.9	166.6	0	0	0	113.5	I345 F350 S368 L369 N375 F376 I385 V441 P457 I471	I345-I372 HydrophobicContact CD1-CG1 4.25Å; I345-I372 HydrophobicContact CG2-CD1 4.03Å; F350-I372 HydrophobicContact CB-CD1 4.31Å; F350-I372 HydrophobicContact CD1-CB 4.39Å; F350-I372 HydrophobicContact CD1-CD1 4.37Å; F350-I372 HydrophobicContact CD1-CG2 3.81Å; F350-I372 HydrophobicContact CD2-CB 4.39Å; F350-I372 HydrophobicContact CD2-CD1 3.36Å; F350-I372 HydrophobicContact CD2-CG1 4.41Å; F350-I372 HydrophobicContact CE1-CB 3.97Å; F350-I372 HydrophobicContact CE1-CG2 3.63Å; F350-I372 HydrophobicContact CE2-CB 3.97Å; F350-I372 HydrophobicContact CE2-CD1 3.66Å; F350-I372 HydrophobicContact CE2-CG1 4.3Å; F350-I372 HydrophobicContact CE2-CG2 4.43Å; F350-I372 HydrophobicContact CG-CD1 3.75Å; F350-I372 HydrophobicContact CG-CG2 4.28Å; F350-I372 HydrophobicContact CZ-CB 3.74Å; F350-I372 HydrophobicContact CZ-CD1 4.29Å; F350-I372 HydrophobicContact CZ-CG2 3.96Å; S368-I372 PolarHBondContact O-N 3.32Å; S368-I372 VanDerWaalsContact O-N 3.13Å; L369-I372 WeakPolarHBondContact O-CG2 3.4Å; I372-N375 WeakPolarHBondContact O-CB 3.39Å; I372-N375 PolarHBondContact O-N 3.29Å; I372-F376 HydrophobicContact CD1-CE2 4.17Å; I372-F376 HydrophobicContact CG1-CD2 4.18Å; I372-F376 HydrophobicContact CG1-CE2 3.72Å; I372-F376 WeakPolarHBondContact O-CD2 3.28Å; I372-I385 HydrophobicContact CG2-CD1 3.94Å; I372-V441 HydrophobicContact CD1-CG1 4.42Å; I372-P457 HydrophobicContact CD1-CB 4.16Å; I372-P457 HydrophobicContact CD1-CG 3.79Å; I372-I471 HydrophobicContact CB-CD1 3.79Å; I372-I471 HydrophobicContact CG1-CD1 4.26Å
373	L	59.3	Low	61.7	Low	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-47.3	171	-78.9	171.6	0	0	0	111.1	L369 L370 N375 F376 I377 T383 I385 L408 L413	L369-L373 WeakPolarHBondContact O-CB 3.17Å; L369-L373 VanDerWaalsContact O-CG 3.29Å; L369-L373 WeakPolarHBondContact O-CG 3.28Å; L369-L373 PolarHBondContact O-N 2.6Å; L370-L373 PolarHBondContact O-N 3.26Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 2.92Å; L373-F376 PolarHBondContact O-N 2.77Å; L373-F376 VanDerWaalsContact O-N 3.16Å; L373-I377 HydrophobicContact CB-CD1 4.05Å; L373-I377 HydrophobicContact CD2-CD1 4.27Å; L373-I377 WeakPolarHBondContact O-CB 3.43Å; L373-I377 VanDerWaalsContact O-CG1 3.26Å; L373-I377 WeakPolarHBondContact O-CG1 3.27Å; L373-I377 PolarHBondContact O-N 2.96Å; L373-T383 HydrophobicContact CD2-CG2 3.91Å; L373-I385 HydrophobicContact CD1-CD1 4.17Å; L373-I385 HydrophobicContact CD2-CD1 3.86Å; L373-I385 HydrophobicContact CD2-CG1 3.84Å; L373-I385 HydrophobicContact CG-CD1 3.63Å; L373-I385 HydrophobicContact CG-CG1 4.21Å; L373-L408 HydrophobicContact CD1-CD1 4.07Å; L373-L408 HydrophobicContact CD1-CD2 3.69Å; L373-L408 HydrophobicContact CD1-CG 4.46Å; L373-L413 HydrophobicContact CD1-CB 4.17Å; L373-L413 HydrophobicContact CD1-CD1 4.41Å; L373-L413 HydrophobicContact CD2-CB 4.35Å
374	L	53.3	Low	61.9	Low	82 Å²	82	39.6 Å²	39.6	43%	0.429	21%	0.208	S	C	.	.	H	α-helix	trans	-63.4	-35.5	179.7	-72	168.4	0	0	0	112.2	L370 F376 I377 L378	L370-L374 WeakPolarHBondContact O-CB 3.17Å; L370-L374 VanDerWaalsContact O-CG 3.23Å; L370-L374 WeakPolarHBondContact O-CG 3.26Å; L370-L374 PolarHBondContact O-N 3.1Å; L374-F376 PolarHBondContact O-N 3.06Å; L374-I377 PolarHBondContact O-N 3.17Å; L374-L378 HydrophobicContact CB-CD1 4.26Å; L374-L378 HydrophobicContact CB-CG 4.49Å; L374-L378 HydrophobicContact CD2-CG 4.46Å; L374-L378 VanDerWaalsContact O-CB 3.3Å; L374-L378 WeakPolarHBondContact O-CB 3.49Å; L374-L378 WeakPolarHBondContact O-CD1 3.32Å; L374-L378 WeakPolarHBondContact O-CG 3.04Å; L374-L378 PolarHBondContact O-N 3.02Å; L374-L378 VanDerWaalsContact O-N 3.07Å
375	N	60.4	Low	62.3	Low	24 Å²	24	39.6 Å²	39.6	13%	0.128	21%	0.207	C	C	.	.	H	α-helix	trans	-56.2	-18.8	174.6	-170.9	91	0	0	0	114	E371 I372 L373 T473	E371-N375 WeakPolarHBondContact O-CB 3.44Å; E371-N375 PolarHBondContact O-N 2.85Å; E371-N375 VanDerWaalsContact O-N 3.17Å; I372-N375 WeakPolarHBondContact O-CB 3.39Å; I372-N375 PolarHBondContact O-N 3.29Å; L373-N375 VanDerWaalsContact C-N 3.3Å; L373-N375 PolarHBondContact O-N 2.92Å; N375-T473 PolarHBondContact ND2-OG1 3.19Å; N375-T473 VanDerWaalsContact ND2-OG1 3.12Å
376	F	57.6	Low	63.1	Low	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-119.1	-33	178.6	-63.1	-64.9	0	0	0	113.4	L317 V343 I345 I372 L373 L374 D379 C381 T383 V441 T473	L317-F376 HydrophobicContact CD1-CD1 3.42Å; L317-F376 VanDerWaalsContact CD1-CD1 3.42Å; L317-F376 HydrophobicContact CD1-CE1 3.61Å; V343-F376 HydrophobicContact CG1-CB 4.35Å; V343-F376 HydrophobicContact CG1-CD1 4.05Å; V343-F376 HydrophobicContact CG1-CD2 4Å; V343-F376 HydrophobicContact CG1-CE1 4.35Å; V343-F376 HydrophobicContact CG1-CE2 4.29Å; V343-F376 HydrophobicContact CG1-CG 3.87Å; V343-F376 HydrophobicContact CG1-CZ 4.46Å; V343-F376 HydrophobicContact CG2-CB 4.44Å; V343-F376 HydrophobicContact CG2-CD1 4.29Å; V343-F376 HydrophobicContact CG2-CG 4.48Å; I345-F376 HydrophobicContact CD1-CD2 3.76Å; I345-F376 HydrophobicContact CD1-CE2 4.02Å; I345-F376 HydrophobicContact CG1-CD2 4.49Å; I345-F376 HydrophobicContact CG1-CE2 4.44Å; I372-F376 HydrophobicContact CD1-CE2 4.17Å; I372-F376 HydrophobicContact CG1-CD2 4.18Å; I372-F376 HydrophobicContact CG1-CE2 3.72Å; I372-F376 WeakPolarHBondContact O-CD2 3.28Å; L373-F376 PolarHBondContact O-N 2.77Å; L373-F376 VanDerWaalsContact O-N 3.16Å; L374-F376 PolarHBondContact O-N 3.06Å; F376-D379 PolarHBondContact O-N 3.24Å; F376-C381 WeakPolarHBondContact O-CB 3.33Å; F376-C381 PolarHBondContact O-N 3.31Å; F376-C381 VanDerWaalsContact O-N 3.14Å; F376-T383 HydrophobicContact CB-CG2 3.9Å; F376-T383 WeakPolarHBondContact CB-OG1 3.46Å; F376-T383 HydrophobicContact CD2-CG2 4.37Å; F376-V441 HydrophobicContact CE2-CG1 4.23Å; F376-V441 HydrophobicContact CE2-CG2 4.2Å; F376-V441 HydrophobicContact CZ-CG1 4.14Å; F376-V441 HydrophobicContact CZ-CG2 3.94Å; F376-T473 HydrophobicContact CE1-CG2 4.01Å; F376-T473 HydrophobicContact CZ-CG2 4.19Å
377	I	52.8	Low	64.1	Low	66 Å²	66	38.4 Å²	38.4	34%	0.338	20%	0.199	S	C	.	.	H	α-helix	trans	-70.5	-32.6	178.4	-68.4	173.2	0	0	0	111.7	L373 L374 D379 G380 L413	L373-I377 HydrophobicContact CB-CD1 4.05Å; L373-I377 HydrophobicContact CD2-CD1 4.27Å; L373-I377 WeakPolarHBondContact O-CB 3.43Å; L373-I377 VanDerWaalsContact O-CG1 3.26Å; L373-I377 WeakPolarHBondContact O-CG1 3.27Å; L373-I377 PolarHBondContact O-N 2.96Å; L374-I377 PolarHBondContact O-N 3.17Å; I377-D379 VanDerWaalsContact C-N 3.3Å; I377-D379 PolarHBondContact O-N 3.21Å; I377-G380 WeakPolarHBondContact O-CA 3.32Å; I377-G380 PolarHBondContact O-N 2.82Å; I377-L413 HydrophobicContact CD1-CD1 4.36Å; I377-L413 HydrophobicContact CD1-CD2 4.02Å
378	L	45.1	Very low	65.3	Low	140 Å²	140	33.6 Å²	33.6	73%	0.733	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-32.1	178.2	-70.5	172.6	0	0	0	112.7	L374 G380	L374-L378 HydrophobicContact CB-CD1 4.26Å; L374-L378 HydrophobicContact CB-CG 4.49Å; L374-L378 HydrophobicContact CD2-CG 4.46Å; L374-L378 VanDerWaalsContact O-CB 3.3Å; L374-L378 WeakPolarHBondContact O-CB 3.49Å; L374-L378 WeakPolarHBondContact O-CD1 3.32Å; L374-L378 WeakPolarHBondContact O-CG 3.04Å; L374-L378 PolarHBondContact O-N 3.02Å; L374-L378 VanDerWaalsContact O-N 3.07Å; L378-G380 PolarHBondContact O-N 2.79Å
379	D	47	Very low	66.2	Low	58 Å²	58	35.9 Å²	35.9	31%	0.31	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.1	172.1	-66.6	-22.5	0	0	0	112.8	L340 F376 I377	L340-D379 WeakPolarHBondContact CD1-O 3.41Å; F376-D379 PolarHBondContact O-N 3.24Å; I377-D379 VanDerWaalsContact C-N 3.3Å; I377-D379 PolarHBondContact O-N 3.21Å
380	G	45	Very low	66.8	Low	35 Å²	35	39.5 Å²	39.5	36%	0.361	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.7	8.4	-177.9	0	0	0	0	0	114.9	I377 L378	I377-G380 WeakPolarHBondContact O-CA 3.32Å; I377-G380 PolarHBondContact O-N 2.82Å; L378-G380 PolarHBondContact O-N 2.79Å
381	C	53.9	Low	67.9	Low	6 Å²	6	37 Å²	37	4%	0.041	19%	0.193	C	C	.	.			trans	-73.9	132.7	-179.6	-59	0	0	0	0	111.8	V343 F376 T383	V343-C381 HydrophobicContact CG2-CB 3.64Å; F376-C381 WeakPolarHBondContact O-CB 3.33Å; F376-C381 PolarHBondContact O-N 3.31Å; F376-C381 VanDerWaalsContact O-N 3.14Å; C381-T383 PolarHBondContact O-N 3.17Å; C381-T383 VanDerWaalsContact O-N 3.14Å; C381-T383 PolarHBondContact O-OG1 3.33Å
382	Q	60.4	Low	69	Low	150 Å²	150	38.3 Å²	38.3	70%	0.701	20%	0.202	S	C	*	.			trans	-64.6	114.2	166.6	176.6	177.6	-13.6	0	0	108.4	P342 V343	P342-Q382 CarbonylContact C-O 3.59Å; P342-Q382 VanDerWaalsContact CA-O 3.27Å; P342-Q382 WeakPolarHBondContact CA-O 3.26Å; P342-Q382 HydrophobicContact CB-CB 4.31Å; V343-Q382 PolarHBondContact N-O 3.42Å
383	T	70.3	Confident	69.4	Low	5 Å²	5	41.9 Å²	41.9	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.4	-166.3	-55.1	0	0	0	0	111.3	V343 I345 L373 F376 C381 L413	V343-T383 HydrophobicContact CB-CG2 4.21Å; V343-T383 HydrophobicContact CG1-CG2 4.25Å; V343-T383 WeakPolarHBondContact O-CA 3.36Å; I345-T383 HydrophobicContact CD1-CG2 3.5Å; I345-T383 VanDerWaalsContact CD1-CG2 3.5Å; I345-T383 HydrophobicContact CG1-CG2 4.31Å; L373-T383 HydrophobicContact CD2-CG2 3.91Å; F376-T383 HydrophobicContact CB-CG2 3.9Å; F376-T383 WeakPolarHBondContact CB-OG1 3.46Å; F376-T383 HydrophobicContact CD2-CG2 4.37Å; C381-T383 PolarHBondContact O-N 3.17Å; C381-T383 VanDerWaalsContact O-N 3.14Å; C381-T383 PolarHBondContact O-OG1 3.33Å; T383-L413 WeakPolarHBondContact O-CD2 3.46Å
384	V	81.6	Confident	69.2	Low	20 Å²	20	44.9 Å²	44.9	12%	0.121	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.2	176.7	-176.7	0	0	0	0	110.5	V343 I345 Y386 Q415	V343-V384 PolarHBondContact O-N 2.95Å; I345-V384 PolarHBondContact N-O 3.07Å; V384-Y386 HydrophobicContact CB-CE2 3.95Å; V384-Y386 HydrophobicContact CG1-CD2 4.27Å; V384-Y386 HydrophobicContact CG1-CE2 3.65Å; V384-Q415 HydrophobicContact CG1-CB 3.85Å
385	I	88.3	Confident	69.5	Low	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.7	168.7	-67.8	177.9	0	0	0	109.7	I345 L369 I372 L373 L387 L413 I414 Q415	I345-I385 HydrophobicContact CB-CG1 3.96Å; I345-I385 HydrophobicContact CD1-CG1 3.84Å; I345-I385 HydrophobicContact CG1-CG1 4.44Å; I345-I385 HydrophobicContact CG2-CG1 4.23Å; L369-I385 HydrophobicContact CB-CD1 4.11Å; L369-I385 HydrophobicContact CD2-CD1 4.12Å; I372-I385 HydrophobicContact CG2-CD1 3.94Å; L373-I385 HydrophobicContact CD1-CD1 4.17Å; L373-I385 HydrophobicContact CD2-CD1 3.86Å; L373-I385 HydrophobicContact CD2-CG1 3.84Å; L373-I385 HydrophobicContact CG-CD1 3.63Å; L373-I385 HydrophobicContact CG-CG1 4.21Å; I385-L387 HydrophobicContact CG2-CD2 4.47Å; I385-L387 HydrophobicContact CG2-CG 4.12Å; I385-L413 PolarHBondContact N-O 2.92Å; I385-I414 HydrophobicContact CB-CG1 4.46Å; I385-I414 CarbonylContact O-C 3.5Å; I385-I414 WeakPolarHBondContact O-CA 3.46Å; I385-Q415 PolarHBondContact O-N 3.15Å
386	Y	91.7	Very high	69.2	Low	6 Å²	6	48.7 Å²	48.7	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.4	173.1	-68.6	-97.1	0	0	0	111	F344 I345 G347 V384 Q415 V417 V429 E432	F344-Y386 HydrophobicContact CB-CE2 4.19Å; F344-Y386 AromaticContact CD1-CE2 3.64Å; F344-Y386 HydrophobicContact CD1-CE2 3.64Å; F344-Y386 AromaticContact CD1-CZ 3.97Å; F344-Y386 HydrophobicContact CG-CE2 4.4Å; I345-Y386 PolarHBondContact O-N 3.22Å; G347-Y386 PolarHBondContact N-O 2.71Å; V384-Y386 HydrophobicContact CB-CE2 3.95Å; V384-Y386 HydrophobicContact CG1-CD2 4.27Å; V384-Y386 HydrophobicContact CG1-CE2 3.65Å; Y386-Q415 WeakPolarHBondContact CA-O 3.46Å; Y386-Q415 HydrophobicContact CD1-CB 4.11Å; Y386-Q415 HydrophobicContact CD1-CG 4.36Å; Y386-Q415 HydrophobicContact CE1-CB 3.85Å; Y386-Q415 HydrophobicContact CE1-CG 3.91Å; Y386-Q415 VanDerWaalsContact CE1-OE1 3.27Å; Y386-Q415 PolarHBondContact OH-OE1 3.2Å; Y386-V417 HydrophobicContact CD1-CG2 3.79Å; Y386-V417 HydrophobicContact CG-CG2 4.49Å; Y386-V429 HydrophobicContact CD2-CB 4.39Å; Y386-V429 HydrophobicContact CD2-CG1 4.07Å; Y386-V429 HydrophobicContact CD2-CG2 4Å; Y386-V429 HydrophobicContact CG-CG2 3.81Å; Y386-E432 HydrophobicContact CE1-CG 4.34Å
387	L	90.5	Very high	69.6	Low	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.1	177.3	-70.3	175.8	0	0	0	110	I364 L369 I385 Y391 F405 I414 Q415 F416 V417	I364-L387 HydrophobicContact CD1-CD1 3.63Å; I364-L387 HydrophobicContact CD1-CD2 3.83Å; I364-L387 HydrophobicContact CD1-CG 4.38Å; L369-L387 HydrophobicContact CD1-CD1 4.31Å; I385-L387 HydrophobicContact CG2-CD2 4.47Å; I385-L387 HydrophobicContact CG2-CG 4.12Å; L387-Y391 HydrophobicContact CB-CD2 4.32Å; L387-F405 HydrophobicContact CD1-CE2 3.74Å; L387-F405 HydrophobicContact CD1-CZ 3.84Å; L387-I414 HydrophobicContact CD1-CD1 4.38Å; L387-I414 HydrophobicContact CD1-CG2 3.96Å; L387-I414 HydrophobicContact CG-CG2 4.46Å; L387-Q415 PolarHBondContact N-O 3.45Å; L387-Q415 VanDerWaalsContact N-O 3.07Å; L387-F416 HydrophobicContact CB-CD1 4.13Å; L387-F416 HydrophobicContact CB-CE1 4.25Å; L387-F416 CarbonylContact O-C 3.41Å; L387-F416 VanDerWaalsContact O-CA 3.28Å; L387-F416 WeakPolarHBondContact O-CA 3.39Å; L387-V417 PolarHBondContact O-N 3.37Å
388	P	88.8	Confident	70.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	148.6	172.5	30.4	-33.9	0	0	0	110.7	L348 Y390 Y391 G419 V425	L348-P388 HydrophobicContact CD1-CG 4.04Å; L348-P388 HydrophobicContact CD2-CG 4.28Å; L348-P388 HydrophobicContact CG-CG 4.41Å; P388-Y390 PolarHBondContact O-N 2.88Å; P388-Y391 HydrophobicContact CG-CD2 3.67Å; P388-Y391 HydrophobicContact CG-CE2 3.6Å; P388-Y391 PolarHBondContact O-N 2.85Å; P388-G419 WeakPolarHBondContact CB-O 3.21Å; P388-V425 HydrophobicContact CB-CG2 3.83Å; P388-V425 HydrophobicContact CG-CG2 4.29Å
389	D	87.6	Confident	72.2	Confident	52 Å²	52	50 Å²	50	28%	0.278	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-55.2	-13.1	176.5	-93.7	85.2	0	0	0	115.1	Y391 N392 F416 V417 D418	D389-Y391 PolarHBondContact O-N 3.21Å; D389-Y391 VanDerWaalsContact O-N 3.11Å; D389-N392 VanDerWaalsContact O-CB 3.27Å; D389-N392 WeakPolarHBondContact O-CB 3.48Å; D389-N392 PolarHBondContact O-N 2.99Å; D389-N392 PolarHBondContact OD2-ND2 3.47Å; D389-F416 VanDerWaalsContact OD1-CB 3.27Å; D389-F416 WeakPolarHBondContact OD1-CB 3.42Å; D389-V417 PolarHBondContact N-O 2.67Å; D389-V417 VanDerWaalsContact N-O 3.14Å; D389-V417 PolarHBondContact OD1-N 3.36Å; D389-D418 PolarHBondContact OD1-N 2.83Å
390	Y	82.4	Confident	73.4	Confident	75 Å²	75	51.6 Å²	51.6	29%	0.294	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-48.5	-33.2	166.6	179.2	-100.2	0	0	0	113.9	L361 P388 K398	L361-Y390 HydrophobicContact CB-CD1 4.33Å; L361-Y390 HydrophobicContact CB-CE1 4.06Å; L361-Y390 HydrophobicContact CD1-CD1 3.48Å; L361-Y390 VanDerWaalsContact CD1-CD1 3.48Å; L361-Y390 HydrophobicContact CD1-CD2 4.02Å; L361-Y390 HydrophobicContact CD1-CE1 3.86Å; L361-Y390 HydrophobicContact CD1-CE2 4.37Å; L361-Y390 HydrophobicContact CD1-CG 3.55Å; P388-Y390 PolarHBondContact O-N 2.88Å; Y390-K398 HydrophobicContact CD1-CD 3.99Å; Y390-K398 HydrophobicContact CE1-CB 4.46Å; Y390-K398 HydrophobicContact CE1-CD 3.6Å; Y390-K398 HydrophobicContact CE1-CG 3.76Å; Y390-K398 VanDerWaalsContact O-CD 3.28Å; Y390-K398 WeakPolarHBondContact O-CD 3.2Å; Y390-K398 VanDerWaalsContact O-CE 3.3Å; Y390-K398 WeakPolarHBondContact O-CE 3.3Å; Y390-K398 PolarHBondContact O-NZ 3.06Å
391	Y	84.1	Confident	74.6	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.008	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-94.4	-5.6	179.9	-59.6	-81.9	0	0	0	114.7	L348 P362 I364 L387 P388 D389 D393 K398 V399 F405	L348-Y391 HydrophobicContact CD2-CE2 4.01Å; P362-Y391 WeakPolarHBondContact CD-OH 3.46Å; P362-Y391 WeakPolarHBondContact O-CE1 3.5Å; P362-Y391 PolarHBondContact O-OH 3.24Å; I364-Y391 HydrophobicContact CD1-CD1 3.52Å; I364-Y391 HydrophobicContact CD1-CD2 3.93Å; I364-Y391 HydrophobicContact CD1-CE1 3.49Å; I364-Y391 VanDerWaalsContact CD1-CE1 3.49Å; I364-Y391 HydrophobicContact CD1-CE2 3.89Å; I364-Y391 HydrophobicContact CD1-CG 3.74Å; I364-Y391 HydrophobicContact CG1-CD1 4.07Å; I364-Y391 HydrophobicContact CG1-CE1 3.61Å; L387-Y391 HydrophobicContact CB-CD2 4.32Å; P388-Y391 HydrophobicContact CG-CD2 3.67Å; P388-Y391 HydrophobicContact CG-CE2 3.6Å; P388-Y391 PolarHBondContact O-N 2.85Å; D389-Y391 PolarHBondContact O-N 3.21Å; D389-Y391 VanDerWaalsContact O-N 3.11Å; Y391-D393 VanDerWaalsContact C-N 3.26Å; Y391-D393 PolarHBondContact O-N 2.84Å; Y391-K398 HydrophobicContact CD1-CB 3.81Å; Y391-K398 HydrophobicContact CD1-CD 4.43Å; Y391-K398 HydrophobicContact CE1-CB 4.03Å; Y391-V399 HydrophobicContact CD1-CG2 4.37Å; Y391-F405 WeakPolarHBondContact O-CE1 3.38Å
392	N	83.6	Confident	75.5	Confident	79 Å²	79	55.4 Å²	55.4	42%	0.422	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-32.4	179.5	-164.4	-4.2	0	0	0	111.5	D389 T394 F416	D389-N392 VanDerWaalsContact O-CB 3.27Å; D389-N392 WeakPolarHBondContact O-CB 3.48Å; D389-N392 PolarHBondContact O-N 2.99Å; D389-N392 PolarHBondContact OD2-ND2 3.47Å; N392-T394 PolarHBondContact O-N 3.09Å; N392-T394 VanDerWaalsContact O-N 3.16Å; N392-F416 HydrophobicContact CB-CD1 4.11Å; N392-F416 HydrophobicContact CB-CD2 3.78Å; N392-F416 HydrophobicContact CB-CE1 4.18Å; N392-F416 HydrophobicContact CB-CE2 3.84Å; N392-F416 HydrophobicContact CB-CG 3.93Å; N392-F416 HydrophobicContact CB-CZ 4.04Å; N392-F416 VanDerWaalsContact CG-CD2 3.42Å; N392-F416 WeakPolarHBondContact OD1-CE2 3.34Å
393	D	73.4	Confident	75.8	Confident	76 Å²	76	53.3 Å²	53.3	41%	0.406	29%	0.29	S	S	.	.			trans	-77.5	96.7	175.1	174.9	9.3	0	0	0	112.5	Y391 T395 N396 K398	Y391-D393 VanDerWaalsContact C-N 3.26Å; Y391-D393 PolarHBondContact O-N 2.84Å; D393-T395 PolarHBondContact O-N 2.87Å; D393-T395 WeakPolarHBondContact OD1-CB 3.26Å; D393-T395 WeakPolarHBondContact OD1-CG2 3.32Å; D393-T395 PolarHBondContact OD1-N 2.95Å; D393-T395 VanDerWaalsContact OD1-N 3.14Å; D393-T395 PolarHBondContact OD1-OG1 3.31Å; D393-T395 PolarHBondContact OD2-OG1 3.01Å; D393-N396 PolarHBondContact O-ND2 3.16Å; D393-N396 PolarHBondContact OD1-ND2 3.25Å; D393-N396 PolarHBondContact OD2-ND2 2.9Å; D393-K398 IonicContact OD2-NZ 3.82Å
394	T	56.4	Low	75.5	Confident	67 Å²	67	56 Å²	56	41%	0.411	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-8	-178.3	55	0	0	0	0	115.3	N392 N396	N392-T394 PolarHBondContact O-N 3.09Å; N392-T394 VanDerWaalsContact O-N 3.16Å; T394-N396 PolarHBondContact O-N 3.42Å
395	T	57.9	Low	75	Confident	119 Å²	119	55.2 Å²	55.2	73%	0.73	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-3.9	-177.1	65.7	0	0	0	0	114.5	D393	D393-T395 PolarHBondContact O-N 2.87Å; D393-T395 WeakPolarHBondContact OD1-CB 3.26Å; D393-T395 WeakPolarHBondContact OD1-CG2 3.32Å; D393-T395 PolarHBondContact OD1-N 2.95Å; D393-T395 VanDerWaalsContact OD1-N 3.14Å; D393-T395 PolarHBondContact OD1-OG1 3.31Å; D393-T395 PolarHBondContact OD2-OG1 3.01Å
396	N	55.5	Low	74.1	Confident	66 Å²	66	59.8 Å²	59.8	35%	0.353	32%	0.32	S	S	.	.	S	Bend	trans	-113.1	155.6	-165.1	-60.4	-104.9	0	0	0	114	D393 T394 K398	D393-N396 PolarHBondContact O-ND2 3.16Å; D393-N396 PolarHBondContact OD1-ND2 3.25Å; D393-N396 PolarHBondContact OD2-ND2 2.9Å; T394-N396 PolarHBondContact O-N 3.42Å; N396-K398 HydrophobicContact CB-CB 4.44Å; N396-K398 HydrophobicContact CB-CD 3.63Å; N396-K398 VanDerWaalsContact CB-CE 3.46Å; N396-K398 HydrophobicContact CB-CG 3.65Å; N396-K398 VanDerWaalsContact CG-NZ 3.27Å; N396-K398 PolarHBondContact ND2-NZ 3.17Å; N396-K398 PolarHBondContact O-N 3.36Å
397	Q	64.6	Low	72.8	Confident	184 Å²	184	65.5 Å²	65.5	86%	0.86	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	27.6	173.8	-57.5	175.6	-1.2	0	0	114.3
398	K	76.3	Confident	71.5	Confident	24 Å²	24	65.6 Å²	65.6	10%	0.104	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.8	-176.7	-60.6	163.8	-171.7	157.4	0	113.1	I363 I364 Y390 Y391 D393 N396	I363-K398 WeakPolarHBondContact CA-O 3.45Å; I364-K398 PolarHBondContact N-O 3.05Å; Y390-K398 HydrophobicContact CD1-CD 3.99Å; Y390-K398 HydrophobicContact CE1-CB 4.46Å; Y390-K398 HydrophobicContact CE1-CD 3.6Å; Y390-K398 HydrophobicContact CE1-CG 3.76Å; Y390-K398 VanDerWaalsContact O-CD 3.28Å; Y390-K398 WeakPolarHBondContact O-CD 3.2Å; Y390-K398 VanDerWaalsContact O-CE 3.3Å; Y390-K398 WeakPolarHBondContact O-CE 3.3Å; Y390-K398 PolarHBondContact O-NZ 3.06Å; Y391-K398 HydrophobicContact CD1-CB 3.81Å; Y391-K398 HydrophobicContact CD1-CD 4.43Å; Y391-K398 HydrophobicContact CE1-CB 4.03Å; D393-K398 IonicContact OD2-NZ 3.82Å; N396-K398 HydrophobicContact CB-CB 4.44Å; N396-K398 HydrophobicContact CB-CD 3.63Å; N396-K398 VanDerWaalsContact CB-CE 3.46Å; N396-K398 HydrophobicContact CB-CG 3.65Å; N396-K398 VanDerWaalsContact CG-NZ 3.27Å; N396-K398 PolarHBondContact ND2-NZ 3.17Å; N396-K398 PolarHBondContact O-N 3.36Å
399	V	77.1	Confident	70.9	Confident	26 Å²	26	66.9 Å²	66.9	16%	0.158	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-141.3	147.1	-173.3	-168.8	0	0	0	0	109.4	I364 T366 Y391 F405	I364-V399 HydrophobicContact CB-CG1 4.33Å; I364-V399 HydrophobicContact CB-CG2 4.33Å; I364-V399 HydrophobicContact CG2-CG1 4.23Å; I364-V399 WeakPolarHBondContact O-CA 3.39Å; T366-V399 WeakPolarHBondContact OG1-CG1 3.43Å; Y391-V399 HydrophobicContact CD1-CG2 4.37Å; V399-F405 HydrophobicContact CG1-CB 3.86Å; V399-F405 HydrophobicContact CG1-CD2 3.76Å; V399-F405 HydrophobicContact CG1-CG 3.88Å; V399-F405 HydrophobicContact CG2-CD1 4.31Å; V399-F405 HydrophobicContact CG2-CD2 4.14Å; V399-F405 HydrophobicContact CG2-CE1 4.39Å; V399-F405 HydrophobicContact CG2-CE2 4.22Å; V399-F405 HydrophobicContact CG2-CG 4.19Å; V399-F405 HydrophobicContact CG2-CZ 4.35Å
400	D	71.7	Confident	69.9	Low	92 Å²	92	70.2 Å²	70.2	49%	0.492	37%	0.372	S	S	.	.	S	Bend	trans	-79.5	-28.1	-177.7	67.7	-9.9	0	0	0	115.7	I364 S365 T366	I364-D400 PolarHBondContact O-N 3.03Å; S365-D400 VanDerWaalsContact CA-OD2 3.28Å; S365-D400 WeakPolarHBondContact CA-OD2 3.33Å; S365-D400 WeakPolarHBondContact CB-OD2 3.47Å; S365-D400 PolarHBondContact OG-OD2 3.26Å; T366-D400 VanDerWaalsContact CB-OD1 3.31Å; T366-D400 WeakPolarHBondContact CB-OD1 3.46Å; T366-D400 PolarHBondContact N-OD1 3.17Å; T366-D400 PolarHBondContact OG1-OD1 3.45Å
401	D	70.2	Confident	68.6	Low	57 Å²	57	69 Å²	69	31%	0.305	38%	0.375	S	S	.	.			trans	-139.9	92.8	176.5	-167.1	-43.5	0	0	0	110.1	T366 T403 I404 F405	T366-D401 PolarHBondContact OG1-O 3.09Å; D401-T403 PolarHBondContact O-N 2.9Å; D401-T403 WeakPolarHBondContact OD1-CB 3.34Å; D401-T403 PolarHBondContact OD1-N 3.02Å; D401-I404 HydrophobicContact CB-CB 4.36Å; D401-I404 HydrophobicContact CB-CD1 4.34Å; D401-I404 HydrophobicContact CB-CG1 4.45Å; D401-I404 PolarHBondContact O-N 3.44Å; D401-I404 PolarHBondContact OD1-N 3Å; D401-I404 WeakPolarHBondContact OD2-CD1 3.5Å; D401-F405 WeakPolarHBondContact O-CB 3.36Å; D401-F405 PolarHBondContact O-N 3.44Å
402	S	72.4	Confident	68.2	Low	64 Å²	64	77.2 Å²	77.2	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-28.1	-178.6	53.3	0	0	0	0	113.4	Q406	S402-Q406 VanDerWaalsContact O-CB 3.26Å; S402-Q406 WeakPolarHBondContact O-CB 3.42Å; S402-Q406 PolarHBondContact O-N 2.78Å
403	T	67.9	Low	67.6	Low	105 Å²	105	75.5 Å²	75.5	64%	0.644	40%	0.401	S	S	*	.	H	α-helix	trans	-70.5	-47.7	-179.9	-55.1	0	0	0	0	110.9	D401 F405 F407	D401-T403 PolarHBondContact O-N 2.9Å; D401-T403 WeakPolarHBondContact OD1-CB 3.34Å; D401-T403 PolarHBondContact OD1-N 3.02Å; T403-F405 VanDerWaalsContact C-N 3.35Å; T403-F407 PolarHBondContact O-N 3.49Å; T403-F407 VanDerWaalsContact O-N 3.09Å
404	I	63	Low	68.1	Low	63 Å²	63	72.2 Å²	72.2	32%	0.323	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-39.7	175.8	-61.8	176.5	0	0	0	110.1	T366 L370 D401 F407 L408	T366-I404 HydrophobicContact CG2-CB 3.84Å; T366-I404 HydrophobicContact CG2-CG2 3.5Å; T366-I404 VanDerWaalsContact CG2-CG2 3.5Å; L370-I404 HydrophobicContact CD1-CG2 3.79Å; L370-I404 HydrophobicContact CG-CG2 4.33Å; D401-I404 HydrophobicContact CB-CB 4.36Å; D401-I404 HydrophobicContact CB-CD1 4.34Å; D401-I404 HydrophobicContact CB-CG1 4.45Å; D401-I404 PolarHBondContact O-N 3.44Å; D401-I404 PolarHBondContact OD1-N 3Å; D401-I404 WeakPolarHBondContact OD2-CD1 3.5Å; I404-F407 WeakPolarHBondContact O-CB 3.47Å; I404-F407 PolarHBondContact O-N 3.47Å; I404-L408 WeakPolarHBondContact O-CG 3.39Å; I404-L408 PolarHBondContact O-N 2.87Å
405	F	70.5	Confident	69.7	Low	3 Å²	3	73.6 Å²	73.6	1%	0.013	39%	0.385	C	S	.	.	H	α-helix	trans	-63	-44.6	178.6	-172.4	-94.8	0	0	0	112.2	I364 T366 L369 L387 Y391 V399 D401 T403 F407 L408 C409 I414 F416	I364-F405 HydrophobicContact CD1-CE2 4.28Å; I364-F405 HydrophobicContact CG2-CE2 4.4Å; T366-F405 HydrophobicContact CG2-CB 4.07Å; L369-F405 HydrophobicContact CD1-CD2 4.2Å; L369-F405 HydrophobicContact CD1-CE2 4.03Å; L387-F405 HydrophobicContact CD1-CE2 3.74Å; L387-F405 HydrophobicContact CD1-CZ 3.84Å; Y391-F405 WeakPolarHBondContact O-CE1 3.38Å; V399-F405 HydrophobicContact CG1-CB 3.86Å; V399-F405 HydrophobicContact CG1-CD2 3.76Å; V399-F405 HydrophobicContact CG1-CG 3.88Å; V399-F405 HydrophobicContact CG2-CD1 4.31Å; V399-F405 HydrophobicContact CG2-CD2 4.14Å; V399-F405 HydrophobicContact CG2-CE1 4.39Å; V399-F405 HydrophobicContact CG2-CE2 4.22Å; V399-F405 HydrophobicContact CG2-CG 4.19Å; V399-F405 HydrophobicContact CG2-CZ 4.35Å; D401-F405 WeakPolarHBondContact O-CB 3.36Å; D401-F405 PolarHBondContact O-N 3.44Å; T403-F405 VanDerWaalsContact C-N 3.35Å; F405-F407 VanDerWaalsContact C-N 3.33Å; F405-F407 PolarHBondContact O-N 3.17Å; F405-L408 PolarHBondContact O-N 2.9Å; F405-C409 PolarHBondContact O-N 2.93Å; F405-C409 PolarHBondContact O-SG 3.4Å; F405-I414 HydrophobicContact CD2-CD1 3.83Å; F405-I414 HydrophobicContact CE2-CD1 3.6Å; F405-I414 HydrophobicContact CZ-CD1 4.11Å; F405-F416 HydrophobicContact CE1-CE1 4.39Å; F405-F416 HydrophobicContact CE1-CZ 4Å; F405-F416 HydrophobicContact CZ-CE1 4.14Å; F405-F416 HydrophobicContact CZ-CZ 4.15Å
406	Q	71.1	Confident	71.2	Confident	95 Å²	95	69.8 Å²	69.8	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-64.8	-35.7	175.8	-168.9	175.2	12.6	0	0	112	S402 C409 N410	S402-Q406 VanDerWaalsContact O-CB 3.26Å; S402-Q406 WeakPolarHBondContact O-CB 3.42Å; S402-Q406 PolarHBondContact O-N 2.78Å; Q406-C409 PolarHBondContact O-N 3.06Å; Q406-N410 WeakPolarHBondContact O-CB 3.26Å; Q406-N410 PolarHBondContact O-N 2.84Å
407	F	64.1	Low	72.8	Confident	127 Å²	127	67.2 Å²	67.2	56%	0.557	35%	0.345	S	S	*	.	H	α-helix	trans	-60.4	-43.1	171	168.4	-94.2	0	0	0	112.5	T403 I404 F405 C409 N410 S411	T403-F407 PolarHBondContact O-N 3.49Å; T403-F407 VanDerWaalsContact O-N 3.09Å; I404-F407 WeakPolarHBondContact O-CB 3.47Å; I404-F407 PolarHBondContact O-N 3.47Å; F405-F407 VanDerWaalsContact C-N 3.33Å; F405-F407 PolarHBondContact O-N 3.17Å; F407-C409 PolarHBondContact O-N 3.46Å; F407-N410 PolarHBondContact O-N 2.98Å; F407-S411 VanDerWaalsContact O-CB 3.28Å; F407-S411 WeakPolarHBondContact O-CB 3.34Å; F407-S411 PolarHBondContact O-N 2.88Å; F407-S411 PolarHBondContact O-OG 3.26Å
408	L	62.7	Low	73.4	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-37.2	177.1	-67.8	177	0	0	0	112.6	T366 L370 L373 I404 F405 S411 K412 L413 I414	T366-L408 HydrophobicContact CG2-CD1 4.07Å; L370-L408 HydrophobicContact CD2-CD1 4.25Å; L370-L408 HydrophobicContact CD2-CD2 3.95Å; L370-L408 HydrophobicContact CG-CD1 4.42Å; L373-L408 HydrophobicContact CD1-CD1 4.07Å; L373-L408 HydrophobicContact CD1-CD2 3.69Å; L373-L408 HydrophobicContact CD1-CG 4.46Å; I404-L408 WeakPolarHBondContact O-CG 3.39Å; I404-L408 PolarHBondContact O-N 2.87Å; F405-L408 PolarHBondContact O-N 2.9Å; L408-S411 PolarHBondContact O-N 3.33Å; L408-K412 PolarHBondContact O-N 2.95Å; L408-L413 HydrophobicContact CD2-CB 4.34Å; L408-L413 HydrophobicContact CD2-CD1 3.85Å; L408-L413 PolarHBondContact O-N 2.81Å; L408-I414 HydrophobicContact CB-CD1 3.65Å; L408-I414 HydrophobicContact CB-CG1 3.98Å; L408-I414 HydrophobicContact CD1-CD1 4.12Å; L408-I414 PolarHBondContact O-N 3.13Å
409	C	75.5	Confident	72.9	Confident	27 Å²	27	66.2 Å²	66.2	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-50.2	173.8	-59.8	0	0	0	0	111.4	F405 Q406 F407 S411 K412 F416	F405-C409 PolarHBondContact O-N 2.93Å; F405-C409 PolarHBondContact O-SG 3.4Å; Q406-C409 PolarHBondContact O-N 3.06Å; F407-C409 PolarHBondContact O-N 3.46Å; C409-S411 PolarHBondContact O-N 3.07Å; C409-K412 PolarHBondContact O-N 2.76Å; C409-F416 HydrophobicContact CB-CE2 4.47Å; C409-F416 VanDerWaalsContact SG-CZ 3.56Å
410	N	66.4	Low	72.3	Confident	122 Å²	122	74.4 Å²	74.4	65%	0.652	38%	0.383	S	S	*	.	H	α-helix	trans	-60.3	-32.5	177.5	-70	-10	0	0	0	112.3	Q406 F407 K412	Q406-N410 WeakPolarHBondContact O-CB 3.26Å; Q406-N410 PolarHBondContact O-N 2.84Å; F407-N410 PolarHBondContact O-N 2.98Å; N410-K412 PolarHBondContact O-N 2.85Å
411	S	56.7	Low	72.2	Confident	50 Å²	50	73 Å²	73	35%	0.35	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.8	175.9	-56.5	0	0	0	0	114	F407 L408 C409 L413	F407-S411 VanDerWaalsContact O-CB 3.28Å; F407-S411 WeakPolarHBondContact O-CB 3.34Å; F407-S411 PolarHBondContact O-N 2.88Å; F407-S411 PolarHBondContact O-OG 3.26Å; L408-S411 PolarHBondContact O-N 3.33Å; C409-S411 PolarHBondContact O-N 3.07Å; S411-L413 PolarHBondContact O-N 2.94Å
412	K	74.8	Confident	72.5	Confident	174 Å²	174	74.3 Å²	74.3	76%	0.757	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	23.6	-173.7	-52.3	-175.4	-180	-175	0	114.4	L408 C409 N410	L408-K412 PolarHBondContact O-N 2.95Å; C409-K412 PolarHBondContact O-N 2.76Å; N410-K412 PolarHBondContact O-N 2.85Å
413	L	71.1	Confident	72.8	Confident	43 Å²	43	79.5 Å²	79.5	23%	0.225	39%	0.391	C	S	.	.	S	Bend	trans	-84.7	-18.3	172.9	-64.2	175.6	0	0	0	111.9	L373 I377 T383 I385 L408 S411	L373-L413 HydrophobicContact CD1-CB 4.17Å; L373-L413 HydrophobicContact CD1-CD1 4.41Å; L373-L413 HydrophobicContact CD2-CB 4.35Å; I377-L413 HydrophobicContact CD1-CD1 4.36Å; I377-L413 HydrophobicContact CD1-CD2 4.02Å; T383-L413 WeakPolarHBondContact O-CD2 3.46Å; I385-L413 PolarHBondContact N-O 2.92Å; L408-L413 HydrophobicContact CD2-CB 4.34Å; L408-L413 HydrophobicContact CD2-CD1 3.85Å; L408-L413 PolarHBondContact O-N 2.81Å; S411-L413 PolarHBondContact O-N 2.94Å
414	I	84.3	Confident	73.4	Confident	7 Å²	7	76 Å²	76	4%	0.036	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.9	166	-65.7	173.8	0	0	0	108	L369 I385 L387 F405 L408 F416	L369-I414 HydrophobicContact CD1-CD1 3.98Å; I385-I414 HydrophobicContact CB-CG1 4.46Å; I385-I414 CarbonylContact O-C 3.5Å; I385-I414 WeakPolarHBondContact O-CA 3.46Å; L387-I414 HydrophobicContact CD1-CD1 4.38Å; L387-I414 HydrophobicContact CD1-CG2 3.96Å; L387-I414 HydrophobicContact CG-CG2 4.46Å; F405-I414 HydrophobicContact CD2-CD1 3.83Å; F405-I414 HydrophobicContact CE2-CD1 3.6Å; F405-I414 HydrophobicContact CZ-CD1 4.11Å; L408-I414 HydrophobicContact CB-CD1 3.65Å; L408-I414 HydrophobicContact CB-CG1 3.98Å; L408-I414 HydrophobicContact CD1-CD1 4.12Å; L408-I414 PolarHBondContact O-N 3.13Å; I414-F416 HydrophobicContact CG2-CD1 4.4Å; I414-F416 HydrophobicContact CG2-CE1 3.87Å; I414-F416 HydrophobicContact CG2-CE2 4.47Å; I414-F416 HydrophobicContact CG2-CZ 3.91Å
415	Q	89.5	Confident	74.4	Confident	96 Å²	96	73 Å²	73	45%	0.449	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.9	169.4	-173.4	170.2	5.3	0	0	109.5	V384 I385 Y386 L387	V384-Q415 HydrophobicContact CG1-CB 3.85Å; I385-Q415 PolarHBondContact O-N 3.15Å; Y386-Q415 WeakPolarHBondContact CA-O 3.46Å; Y386-Q415 HydrophobicContact CD1-CB 4.11Å; Y386-Q415 HydrophobicContact CD1-CG 4.36Å; Y386-Q415 HydrophobicContact CE1-CB 3.85Å; Y386-Q415 HydrophobicContact CE1-CG 3.91Å; Y386-Q415 VanDerWaalsContact CE1-OE1 3.27Å; Y386-Q415 PolarHBondContact OH-OE1 3.2Å; L387-Q415 PolarHBondContact N-O 3.45Å; L387-Q415 VanDerWaalsContact N-O 3.07Å
416	F	90.6	Very high	75.1	Confident	40 Å²	40	74.7 Å²	74.7	18%	0.175	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	153.3	177.9	-59.4	-67.9	0	0	0	112	L387 D389 N392 F405 C409 I414	L387-F416 HydrophobicContact CB-CD1 4.13Å; L387-F416 HydrophobicContact CB-CE1 4.25Å; L387-F416 CarbonylContact O-C 3.41Å; L387-F416 VanDerWaalsContact O-CA 3.28Å; L387-F416 WeakPolarHBondContact O-CA 3.39Å; D389-F416 VanDerWaalsContact OD1-CB 3.27Å; D389-F416 WeakPolarHBondContact OD1-CB 3.42Å; N392-F416 HydrophobicContact CB-CD1 4.11Å; N392-F416 HydrophobicContact CB-CD2 3.78Å; N392-F416 HydrophobicContact CB-CE1 4.18Å; N392-F416 HydrophobicContact CB-CE2 3.84Å; N392-F416 HydrophobicContact CB-CG 3.93Å; N392-F416 HydrophobicContact CB-CZ 4.04Å; N392-F416 VanDerWaalsContact CG-CD2 3.42Å; N392-F416 WeakPolarHBondContact OD1-CE2 3.34Å; F405-F416 HydrophobicContact CE1-CE1 4.39Å; F405-F416 HydrophobicContact CE1-CZ 4Å; F405-F416 HydrophobicContact CZ-CE1 4.14Å; F405-F416 HydrophobicContact CZ-CZ 4.15Å; C409-F416 HydrophobicContact CB-CE2 4.47Å; C409-F416 VanDerWaalsContact SG-CZ 3.56Å; I414-F416 HydrophobicContact CG2-CD1 4.4Å; I414-F416 HydrophobicContact CG2-CE1 3.87Å; I414-F416 HydrophobicContact CG2-CE2 4.47Å; I414-F416 HydrophobicContact CG2-CZ 3.91Å
417	V	88.2	Confident	75.8	Confident	12 Å²	12	78.1 Å²	78.1	7%	0.073	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.9	-179.8	-175.6	0	0	0	0	109.3	Y386 L387 D389 G419 V425 Q428	Y386-V417 HydrophobicContact CD1-CG2 3.79Å; Y386-V417 HydrophobicContact CG-CG2 4.49Å; L387-V417 PolarHBondContact O-N 3.37Å; D389-V417 PolarHBondContact N-O 2.67Å; D389-V417 VanDerWaalsContact N-O 3.14Å; D389-V417 PolarHBondContact OD1-N 3.36Å; V417-G419 PolarHBondContact O-N 3.13Å; V417-V425 HydrophobicContact CB-CG2 4.29Å; V417-V425 HydrophobicContact CG2-CG1 4.42Å; V417-Q428 HydrophobicContact CG1-CB 3.79Å; V417-Q428 HydrophobicContact CG1-CG 4.13Å; V417-Q428 HydrophobicContact CG2-CB 3.97Å; V417-Q428 HydrophobicContact CG2-CG 4.07Å
418	D	76.4	Confident	76.9	Confident	153 Å²	153	75.1 Å²	75.1	82%	0.818	36%	0.362	S	S	*	.	S	Bend	trans	-55.5	104	179.8	-90.7	-55.9	0	0	0	112.2	D389	D389-D418 PolarHBondContact OD1-N 2.83Å
419	G	66.3	Low	78.1	Confident	34 Å²	34	75.1 Å²	75.1	35%	0.351	36%	0.361	S	S	.	.	S	Bend	trans	131.3	162.9	172.7	0	0	0	0	0	114.3	P388 V417	P388-G419 WeakPolarHBondContact CB-O 3.21Å; V417-G419 PolarHBondContact O-N 3.13Å
420	R	65.6	Low	78.6	Confident	198 Å²	198	75.4 Å²	75.4	75%	0.747	36%	0.361	S	S	*	.	S	Bend	trans	-96.3	12	178.5	-58.1	-175.1	-178.7	178.9	0.4	113.2
421	S	68.9	Low	79.6	Confident	61 Å²	61	74.2 Å²	74.2	43%	0.427	35%	0.354	S	S	.	.			trans	-99.3	125.3	-171.4	-177.7	0	0	0	0	111.7	R423 A424 V425	S421-R423 PolarHBondContact O-N 3.36Å; S421-A424 WeakPolarHBondContact O-CB 3.29Å; S421-A424 PolarHBondContact O-N 3.12Å; S421-V425 PolarHBondContact O-N 2.74Å
422	R	75.9	Confident	81	Confident	86 Å²	86	73.6 Å²	73.6	33%	0.325	35%	0.345	S	S	.	.	H	α-helix	trans	-43.1	-51.7	170	179	63.3	155.7	-86.4	1.7	111.9	D352 A424 V425 E426	D352-R422 IonicContact OD1-NH1 2.66Å; D352-R422 IonicContact OD2-CZ 2.66Å; D352-R422 IonicContact OD2-NH1 2.6Å; D352-R422 PolarHBondContact OD2-NH1 3.21Å; D352-R422 IonicContact OD2-NH2 2.82Å; D352-R422 PolarHBondContact OD2-NH2 3.3Å; R422-A424 PolarHBondContact O-N 3.42Å; R422-V425 PolarHBondContact O-N 2.73Å; R422-E426 VanDerWaalsContact O-CB 3.28Å; R422-E426 WeakPolarHBondContact O-CB 3.4Å; R422-E426 PolarHBondContact O-N 2.88Å
423	R	79.3	Confident	81.1	Confident	173 Å²	173	65.3 Å²	65.3	65%	0.653	31%	0.309	S	S	*	.	H	α-helix	trans	-67.4	-15.8	-178.8	-68	178.5	177.5	166.8	-1.6	114.7	S421 R427	S421-R423 PolarHBondContact O-N 3.36Å; R423-R427 WeakPolarHBondContact O-CB 3.44Å; R423-R427 VanDerWaalsContact O-CD 3.22Å; R423-R427 WeakPolarHBondContact O-CD 3.36Å; R423-R427 WeakPolarHBondContact O-CG 3.23Å; R423-R427 PolarHBondContact O-N 3.43Å
424	A	80.4	Confident	81.4	Confident	31 Å²	31	64.7 Å²	64.7	26%	0.256	31%	0.306	S	S	.	.	H	α-helix	trans	-80.2	-47.1	174.1	0	0	0	0	0	110.3	S421 R422 R427 Q428	S421-A424 WeakPolarHBondContact O-CB 3.29Å; S421-A424 PolarHBondContact O-N 3.12Å; R422-A424 PolarHBondContact O-N 3.42Å; A424-R427 PolarHBondContact O-N 3.17Å; A424-Q428 PolarHBondContact O-N 3.08Å
425	V	84.2	Confident	81.3	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.8	-58	175	-174.6	0	0	0	0	110	L348 P388 V417 S421 R422 R427 Q428 V429	L348-V425 HydrophobicContact CD1-CB 4.39Å; L348-V425 HydrophobicContact CD1-CG2 4Å; P388-V425 HydrophobicContact CB-CG2 3.83Å; P388-V425 HydrophobicContact CG-CG2 4.29Å; V417-V425 HydrophobicContact CB-CG2 4.29Å; V417-V425 HydrophobicContact CG2-CG1 4.42Å; S421-V425 PolarHBondContact O-N 2.74Å; R422-V425 PolarHBondContact O-N 2.73Å; V425-R427 VanDerWaalsContact C-N 3.32Å; V425-R427 PolarHBondContact O-N 3.3Å; V425-Q428 WeakPolarHBondContact O-CA 3.45Å; V425-Q428 WeakPolarHBondContact O-CB 3.46Å; V425-Q428 PolarHBondContact O-N 3.1Å; V425-V429 HydrophobicContact CG1-CG2 4.2Å; V425-V429 WeakPolarHBondContact O-CG2 3.3Å; V425-V429 PolarHBondContact O-N 2.91Å
426	E	85.3	Confident	80.3	Confident	39 Å²	39	69.4 Å²	69.4	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-43.7	-51.2	176	-178.6	-165.2	115.1	0	0	112.9	R422 L430 F447	R422-E426 VanDerWaalsContact O-CB 3.28Å; R422-E426 WeakPolarHBondContact O-CB 3.4Å; R422-E426 PolarHBondContact O-N 2.88Å; E426-L430 PolarHBondContact O-N 3.28Å; E426-F447 HydrophobicContact CG-CE1 3.69Å; E426-F447 HydrophobicContact CG-CZ 3.63Å
427	R	85.1	Confident	79.2	Confident	167 Å²	167	71.6 Å²	71.6	63%	0.63	34%	0.341	S	S	*	.	H	α-helix	trans	-67.1	-39.6	176.8	-75.3	173.8	-178.6	-170.9	-4	113	R423 A424 V425 L430 L431	R423-R427 WeakPolarHBondContact O-CB 3.44Å; R423-R427 VanDerWaalsContact O-CD 3.22Å; R423-R427 WeakPolarHBondContact O-CD 3.36Å; R423-R427 WeakPolarHBondContact O-CG 3.23Å; R423-R427 PolarHBondContact O-N 3.43Å; A424-R427 PolarHBondContact O-N 3.17Å; V425-R427 VanDerWaalsContact C-N 3.32Å; V425-R427 PolarHBondContact O-N 3.3Å; R427-L430 PolarHBondContact O-N 3.3Å; R427-L431 WeakPolarHBondContact O-CB 3.42Å; R427-L431 VanDerWaalsContact O-CG 3.23Å; R427-L431 WeakPolarHBondContact O-CG 3.34Å; R427-L431 PolarHBondContact O-N 3.47Å
428	Q	87.1	Confident	78	Confident	64 Å²	64	71 Å²	71	30%	0.299	34%	0.337	S	S	.	.	H	α-helix	trans	-65.9	-43.9	179.2	-164.1	67.1	27.7	0	0	111.1	V417 A424 V425 L430 L431 E432	V417-Q428 HydrophobicContact CG1-CB 3.79Å; V417-Q428 HydrophobicContact CG1-CG 4.13Å; V417-Q428 HydrophobicContact CG2-CB 3.97Å; V417-Q428 HydrophobicContact CG2-CG 4.07Å; A424-Q428 PolarHBondContact O-N 3.08Å; V425-Q428 WeakPolarHBondContact O-CA 3.45Å; V425-Q428 WeakPolarHBondContact O-CB 3.46Å; V425-Q428 PolarHBondContact O-N 3.1Å; Q428-L430 VanDerWaalsContact C-N 3.31Å; Q428-L430 PolarHBondContact O-N 2.92Å; Q428-L431 PolarHBondContact O-N 2.97Å; Q428-E432 HydrophobicContact CG-CG 4.49Å; Q428-E432 PolarHBondContact NE2-OE1 2.99Å; Q428-E432 WeakPolarHBondContact O-CG 3.29Å; Q428-E432 PolarHBondContact O-N 2.71Å
429	V	88.1	Confident	77.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.3	-45.6	176.9	-166.5	0	0	0	0	110.5	F344 D346 Y386 V425 A433 F440	F344-V429 VanDerWaalsContact C-CG1 3.41Å; F344-V429 HydrophobicContact CB-CG1 3.59Å; F344-V429 WeakPolarHBondContact O-CG1 3.44Å; D346-V429 HydrophobicContact CB-CG2 4.15Å; Y386-V429 HydrophobicContact CD2-CB 4.39Å; Y386-V429 HydrophobicContact CD2-CG1 4.07Å; Y386-V429 HydrophobicContact CD2-CG2 4Å; Y386-V429 HydrophobicContact CG-CG2 3.81Å; V425-V429 HydrophobicContact CG1-CG2 4.2Å; V425-V429 WeakPolarHBondContact O-CG2 3.3Å; V425-V429 PolarHBondContact O-N 2.91Å; V429-A433 WeakPolarHBondContact O-CB 3.08Å; V429-A433 PolarHBondContact O-N 2.76Å; V429-F440 HydrophobicContact CB-CD2 4.1Å; V429-F440 HydrophobicContact CB-CE2 3.94Å; V429-F440 HydrophobicContact CG1-CD2 3.82Å; V429-F440 HydrophobicContact CG1-CE2 4.05Å
430	L	85.9	Confident	78.1	Confident	33 Å²	33	62.2 Å²	62.2	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-43.2	177.3	-179.5	60.8	0	0	0	112	E426 R427 Q428 A433 E434 F440 F447 T449	E426-L430 PolarHBondContact O-N 3.28Å; R427-L430 PolarHBondContact O-N 3.3Å; Q428-L430 VanDerWaalsContact C-N 3.31Å; Q428-L430 PolarHBondContact O-N 2.92Å; L430-A433 PolarHBondContact O-N 2.91Å; L430-E434 HydrophobicContact CD1-CG 4.04Å; L430-E434 HydrophobicContact CG-CG 4.37Å; L430-E434 WeakPolarHBondContact O-CB 3.2Å; L430-E434 VanDerWaalsContact O-CG 3.25Å; L430-E434 WeakPolarHBondContact O-CG 3.41Å; L430-E434 PolarHBondContact O-N 3.13Å; L430-F440 HydrophobicContact CB-CD2 3.97Å; L430-F440 HydrophobicContact CB-CE2 3.84Å; L430-F440 HydrophobicContact CD1-CD2 4.21Å; L430-F440 HydrophobicContact CD1-CG 4.18Å; L430-F447 HydrophobicContact CD2-CD1 3.99Å; L430-T449 HydrophobicContact CD1-CG2 3.69Å
431	L	87.1	Confident	78.8	Confident	97 Å²	97	52.9 Å²	52.9	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-44	178.5	-76.1	167.2	0	0	0	112.4	R427 Q428 E434 K435	R427-L431 WeakPolarHBondContact O-CB 3.42Å; R427-L431 VanDerWaalsContact O-CG 3.23Å; R427-L431 WeakPolarHBondContact O-CG 3.34Å; R427-L431 PolarHBondContact O-N 3.47Å; Q428-L431 PolarHBondContact O-N 2.97Å; L431-E434 PolarHBondContact O-N 3.07Å; L431-K435 VanDerWaalsContact O-CG 3.3Å; L431-K435 WeakPolarHBondContact O-CG 3.34Å; L431-K435 PolarHBondContact O-N 2.84Å; L431-K435 VanDerWaalsContact O-N 3.13Å
432	E	86.7	Confident	79.4	Confident	37 Å²	37	50 Å²	50	17%	0.173	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-39.9	176.4	-60.9	-49.9	146	0	0	111.8	F344 Y386 Q428 K435	F344-E432 HydrophobicContact CD1-CB 3.59Å; F344-E432 HydrophobicContact CE1-CB 3.54Å; F344-E432 HydrophobicContact CZ-CB 4.4Å; Y386-E432 HydrophobicContact CE1-CG 4.34Å; Q428-E432 HydrophobicContact CG-CG 4.49Å; Q428-E432 PolarHBondContact NE2-OE1 2.99Å; Q428-E432 WeakPolarHBondContact O-CG 3.29Å; Q428-E432 PolarHBondContact O-N 2.71Å; E432-K435 PolarHBondContact O-N 2.68Å; E432-K435 IonicContact OE1-NZ 3.12Å; E432-K435 PolarHBondContact OE1-NZ 2.86Å; E432-K435 WeakPolarHBondContact OE2-CD 3.39Å; E432-K435 WeakPolarHBondContact OE2-CE 3.28Å; E432-K435 IonicContact OE2-NZ 2.62Å; E432-K435 PolarHBondContact OE2-NZ 3.18Å
433	A	78.3	Confident	79.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-44.6	174.5	0	0	0	0	0	112.4	F344 V429 L430 K435 V436 H437 G438 F440 A452	F344-A433 HydrophobicContact CB-CB 4.16Å; F344-A433 HydrophobicContact CD2-CB 3.78Å; F344-A433 HydrophobicContact CE2-CB 4.47Å; F344-A433 HydrophobicContact CG-CB 4.07Å; V429-A433 WeakPolarHBondContact O-CB 3.08Å; V429-A433 PolarHBondContact O-N 2.76Å; L430-A433 PolarHBondContact O-N 2.91Å; A433-K435 PolarHBondContact O-N 3.48Å; A433-V436 PolarHBondContact O-N 3.3Å; A433-H437 PolarHBondContact O-N 3.29Å; A433-H437 VanDerWaalsContact O-N 3.17Å; A433-G438 PolarHBondContact O-N 3.42Å; A433-F440 HydrophobicContact CB-CB 3.86Å; A433-A452 HydrophobicContact CB-CB 3.87Å
434	E	77.3	Confident	78.8	Confident	31 Å²	31	41.3 Å²	41.3	15%	0.145	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-37	179.5	-75.9	-75.8	136.8	0	0	112.7	L430 L431 V436 T449 R450 N451 A452	L430-E434 HydrophobicContact CD1-CG 4.04Å; L430-E434 HydrophobicContact CG-CG 4.37Å; L430-E434 WeakPolarHBondContact O-CB 3.2Å; L430-E434 VanDerWaalsContact O-CG 3.25Å; L430-E434 WeakPolarHBondContact O-CG 3.41Å; L430-E434 PolarHBondContact O-N 3.13Å; L431-E434 PolarHBondContact O-N 3.07Å; E434-V436 VanDerWaalsContact C-N 3.34Å; E434-V436 PolarHBondContact O-N 3.4Å; E434-T449 WeakPolarHBondContact OE1-CA 3.5Å; E434-T449 WeakPolarHBondContact OE1-CB 3.32Å; E434-R450 PolarHBondContact OE1-N 2.84Å; E434-R450 WeakPolarHBondContact OE2-CB 3.35Å; E434-R450 PolarHBondContact OE2-N 3.21Å; E434-N451 PolarHBondContact OE1-N 2.85Å; E434-N451 WeakPolarHBondContact OE2-CB 3.38Å; E434-N451 PolarHBondContact OE2-N 3.07Å; E434-A452 HydrophobicContact CG-CB 4.23Å; E434-A452 WeakPolarHBondContact OE1-CB 3.28Å; E434-A452 PolarHBondContact OE1-N 3.39Å
435	K	80.6	Confident	77.7	Confident	130 Å²	130	48.4 Å²	48.4	57%	0.565	24%	0.236	S	C	*	.	H	α-helix	trans	-59.2	-39.9	178.6	-77.3	175.2	-153.4	172.4	0	113.7	L431 E432 A433	L431-K435 VanDerWaalsContact O-CG 3.3Å; L431-K435 WeakPolarHBondContact O-CG 3.34Å; L431-K435 PolarHBondContact O-N 2.84Å; L431-K435 VanDerWaalsContact O-N 3.13Å; E432-K435 PolarHBondContact O-N 2.68Å; E432-K435 IonicContact OE1-NZ 3.12Å; E432-K435 PolarHBondContact OE1-NZ 2.86Å; E432-K435 WeakPolarHBondContact OE2-CD 3.39Å; E432-K435 WeakPolarHBondContact OE2-CE 3.28Å; E432-K435 IonicContact OE2-NZ 2.62Å; E432-K435 PolarHBondContact OE2-NZ 3.18Å; A433-K435 PolarHBondContact O-N 3.48Å
436	V	70.1	Confident	76.6	Confident	72 Å²	72	55.8 Å²	55.8	44%	0.436	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	10	-172.8	-54.9	0	0	0	0	113.1	P342 F344 A433 E434 G438	P342-V436 HydrophobicContact CG-CB 4.4Å; P342-V436 HydrophobicContact CG-CG2 3.55Å; F344-V436 HydrophobicContact CE2-CG2 3.49Å; F344-V436 VanDerWaalsContact CE2-CG2 3.49Å; F344-V436 HydrophobicContact CZ-CG2 3.52Å; A433-V436 PolarHBondContact O-N 3.3Å; E434-V436 VanDerWaalsContact C-N 3.34Å; E434-V436 PolarHBondContact O-N 3.4Å; V436-G438 VanDerWaalsContact C-N 3.29Å; V436-G438 PolarHBondContact O-N 2.91Å
437	H	67.7	Low	75.8	Confident	86 Å²	86	55.6 Å²	55.6	40%	0.398	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	48.6	-171.2	-52	-105.4	0	0	0	111.2	R341 A433 N451	R341-H437 WeakPolarHBondContact CD-O 3.3Å; R341-H437 WeakPolarHBondContact CG-O 3.49Å; R341-H437 PolarHBondContact NE-O 3.38Å; R341-H437 VanDerWaalsContact NE-O 3.11Å; R341-H437 PolarHBondContact NH1-O 3.24Å; A433-H437 PolarHBondContact O-N 3.29Å; A433-H437 VanDerWaalsContact O-N 3.17Å; H437-N451 PolarHBondContact CE1-ND2 2.88Å; H437-N451 WeakPolarHBondContact ND1-CB 3.3Å
438	G	61.1	Low	74.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.			trans	-80.1	-168.8	-178.2	0	0	0	0	0	114.7	P342 A433 V436 A452 I453	P342-G438 CarbonylContact O-C 3.5Å; P342-G438 WeakPolarHBondContact O-CA 3.42Å; A433-G438 PolarHBondContact O-N 3.42Å; V436-G438 VanDerWaalsContact C-N 3.29Å; V436-G438 PolarHBondContact O-N 2.91Å; G438-A452 WeakPolarHBondContact O-CA 3.45Å; G438-I453 PolarHBondContact O-N 3.02Å
439	V	68.9	Low	73.7	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.9	163.7	-176.9	0	0	0	0	108	L317 R341 P342 V343 F344 V441 I453 C455 F475	L317-V439 HydrophobicContact CD2-CG2 4.26Å; R341-V439 HydrophobicContact CB-CG2 4.21Å; P342-V439 PolarHBondContact O-N 2.85Å; V343-V439 HydrophobicContact CB-CB 4.5Å; V343-V439 HydrophobicContact CG1-CB 4.46Å; V343-V439 HydrophobicContact CG2-CB 4.08Å; V343-V439 HydrophobicContact CG2-CG2 4.23Å; F344-V439 PolarHBondContact N-O 3.11Å; V439-V441 HydrophobicContact CG1-CG2 3.97Å; V439-I453 HydrophobicContact CG2-CB 4.47Å; V439-I453 HydrophobicContact CG2-CD1 3.95Å; V439-C455 HydrophobicContact CG1-CB 3.52Å; V439-F475 HydrophobicContact CG1-CE1 4.19Å
440	F	77.4	Confident	72.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.1	172.4	166.1	-96.7	0	0	0	109.2	V429 L430 A433 S442 F447 A452 I453 Q454 C455	V429-F440 HydrophobicContact CB-CD2 4.1Å; V429-F440 HydrophobicContact CB-CE2 3.94Å; V429-F440 HydrophobicContact CG1-CD2 3.82Å; V429-F440 HydrophobicContact CG1-CE2 4.05Å; L430-F440 HydrophobicContact CB-CD2 3.97Å; L430-F440 HydrophobicContact CB-CE2 3.84Å; L430-F440 HydrophobicContact CD1-CD2 4.21Å; L430-F440 HydrophobicContact CD1-CG 4.18Å; A433-F440 HydrophobicContact CB-CB 3.86Å; F440-S442 VanDerWaalsContact CZ-CB 3.43Å; F440-F447 HydrophobicContact CE1-CB 4.35Å; F440-F447 HydrophobicContact CE1-CD1 4.49Å; F440-F447 AromaticContact CE1-CD2 3.41Å; F440-F447 HydrophobicContact CE1-CD2 3.41Å; F440-F447 VanDerWaalsContact CE1-CD2 3.41Å; F440-F447 AromaticContact CE1-CE2 3.68Å; F440-F447 HydrophobicContact CE1-CE2 3.68Å; F440-F447 AromaticContact CE1-CG 3.85Å; F440-F447 HydrophobicContact CE1-CG 3.85Å; F440-F447 HydrophobicContact CE1-CZ 4.35Å; F440-F447 HydrophobicContact CZ-CD1 4.33Å; F440-F447 AromaticContact CZ-CD2 3.83Å; F440-F447 HydrophobicContact CZ-CD2 3.83Å; F440-F447 HydrophobicContact CZ-CE1 4.24Å; F440-F447 AromaticContact CZ-CE2 3.7Å; F440-F447 HydrophobicContact CZ-CE2 3.7Å; F440-F447 HydrophobicContact CZ-CG 4.13Å; F440-F447 AromaticContact CZ-CZ 3.93Å; F440-F447 HydrophobicContact CZ-CZ 3.93Å; F440-A452 HydrophobicContact CB-CB 4.41Å; F440-I453 PolarHBondContact N-O 3.29Å; F440-Q454 HydrophobicContact CD1-CG 4.17Å; F440-C455 WeakPolarHBondContact O-CB 3.46Å; F440-C455 PolarHBondContact O-N 3.37Å
441	V	79.6	Confident	71.5	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.8	-175.9	-172.5	0	0	0	0	110.2	V343 F344 I345 D346 I372 F376 V439 C455 P457	V343-V441 HydrophobicContact CG1-CG2 3.5Å; F344-V441 PolarHBondContact O-N 2.64Å; I345-V441 HydrophobicContact CB-CB 4.31Å; I345-V441 HydrophobicContact CG1-CB 4Å; I345-V441 HydrophobicContact CG1-CG1 4.49Å; I345-V441 HydrophobicContact CG1-CG2 4.12Å; I345-V441 HydrophobicContact CG2-CB 4.32Å; I345-V441 HydrophobicContact CG2-CG1 4.34Å; D346-V441 PolarHBondContact N-O 2.76Å; I372-V441 HydrophobicContact CD1-CG1 4.42Å; F376-V441 HydrophobicContact CE2-CG1 4.23Å; F376-V441 HydrophobicContact CE2-CG2 4.2Å; F376-V441 HydrophobicContact CZ-CG1 4.14Å; F376-V441 HydrophobicContact CZ-CG2 3.94Å; V439-V441 HydrophobicContact CG1-CG2 3.97Å; V441-C455 WeakPolarHBondContact CA-O 3.36Å; V441-C455 HydrophobicContact CG2-CB 4Å; V441-P457 HydrophobicContact CG1-CG 3.53Å
442	S	82.3	Confident	70.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.014	30%	0.301	C	S	.	.			trans	-153.1	164.4	177.5	-171.9	0	0	0	0	110.9	D346 S349 F440 C455 F456	D346-S442 PolarHBondContact OD2-OG 2.91Å; S349-S442 VanDerWaalsContact CB-OG 3.28Å; S349-S442 WeakPolarHBondContact CB-OG 3.36Å; S349-S442 PolarHBondContact OG-OG 3.06Å; S349-S442 VanDerWaalsContact OG-OG 3.14Å; F440-S442 VanDerWaalsContact CZ-CB 3.43Å; S442-C455 PolarHBondContact N-O 3.09Å; S442-C455 VanDerWaalsContact N-O 3.1Å; S442-F456 WeakPolarHBondContact O-CD1 3.35Å
443	S	74.2	Confident	69.1	Low	37 Å²	37	60.6 Å²	60.6	26%	0.259	30%	0.296	S	S	.	.	S	Bend	trans	-105.3	0.4	178.3	80.1	0	0	0	0	114.1	S349 M353	S349-S443 PolarHBondContact O-OG 3.47Å; S349-S443 VanDerWaalsContact O-OG 3.11Å; S349-S443 PolarHBondContact OG-N 3.11Å; S349-S443 PolarHBondContact OG-OG 2.84Å; M353-S443 WeakPolarHBondContact SD-CB 3.33Å
444	A	67.9	Low	68.4	Low	38 Å²	38	60.6 Å²	60.6	31%	0.314	30%	0.296	S	S	.	.	S	Bend	trans	-81.5	139	172.4	0	0	0	0	0	110.5	F447 Q454	A444-F447 HydrophobicContact CB-CE2 3.69Å; A444-F447 HydrophobicContact CB-CZ 3.91Å; A444-F447 WeakPolarHBondContact O-CE2 3.41Å; A444-Q454 PolarHBondContact O-NE2 3.08Å
445	E	57.7	Low	67.9	Low	180 Å²	180	59.1 Å²	59.1	84%	0.841	29%	0.289	S	S	*	.	S	Bend	trans	-73.3	137	-170.5	-63.6	177.5	152.4	0	0	112
446	E	61.3	Low	67.2	Low	155 Å²	155	54.7 Å²	54.7	72%	0.724	27%	0.27	S	S	*	.			trans	45.4	81.1	169.8	-58.5	-167.6	160.7	0	0	117.2
447	F	66.5	Low	66.9	Low	36 Å²	36	51.4 Å²	51.4	16%	0.158	25%	0.25	C	S	.	.			trans	-83.7	136.3	164.1	-70.5	-94.7	0	0	0	111	E426 L430 F440 A444 T449	E426-F447 HydrophobicContact CG-CE1 3.69Å; E426-F447 HydrophobicContact CG-CZ 3.63Å; L430-F447 HydrophobicContact CD2-CD1 3.99Å; F440-F447 HydrophobicContact CE1-CB 4.35Å; F440-F447 HydrophobicContact CE1-CD1 4.49Å; F440-F447 AromaticContact CE1-CD2 3.41Å; F440-F447 HydrophobicContact CE1-CD2 3.41Å; F440-F447 VanDerWaalsContact CE1-CD2 3.41Å; F440-F447 AromaticContact CE1-CE2 3.68Å; F440-F447 HydrophobicContact CE1-CE2 3.68Å; F440-F447 AromaticContact CE1-CG 3.85Å; F440-F447 HydrophobicContact CE1-CG 3.85Å; F440-F447 HydrophobicContact CE1-CZ 4.35Å; F440-F447 HydrophobicContact CZ-CD1 4.33Å; F440-F447 AromaticContact CZ-CD2 3.83Å; F440-F447 HydrophobicContact CZ-CD2 3.83Å; F440-F447 HydrophobicContact CZ-CE1 4.24Å; F440-F447 AromaticContact CZ-CE2 3.7Å; F440-F447 HydrophobicContact CZ-CE2 3.7Å; F440-F447 HydrophobicContact CZ-CG 4.13Å; F440-F447 AromaticContact CZ-CZ 3.93Å; F440-F447 HydrophobicContact CZ-CZ 3.93Å; A444-F447 HydrophobicContact CB-CE2 3.69Å; A444-F447 HydrophobicContact CB-CZ 3.91Å; A444-F447 WeakPolarHBondContact O-CE2 3.41Å; F447-T449 PolarHBondContact O-N 2.83Å
448	L	65.3	Low	66.6	Low	171 Å²	171	50.1 Å²	50.1	90%	0.895	25%	0.249	S	C	*	.			trans	-71.7	72.1	169.2	-74	167.1	0	0	0	111.1
449	T	63.9	Low	66.7	Low	18 Å²	18	51.4 Å²	51.4	11%	0.11	26%	0.255	C	S	.	.			trans	-67.4	145	165.7	42.6	0	0	0	0	110.3	L430 E434 F447 A452 Q454 N478	L430-T449 HydrophobicContact CD1-CG2 3.69Å; E434-T449 WeakPolarHBondContact OE1-CA 3.5Å; E434-T449 WeakPolarHBondContact OE1-CB 3.32Å; F447-T449 PolarHBondContact O-N 2.83Å; T449-A452 WeakPolarHBondContact CB-O 3.25Å; T449-A452 HydrophobicContact CG2-CB 4.14Å; T449-Q454 HydrophobicContact CG2-CB 4.4Å; T449-N478 PolarHBondContact OG1-ND2 2.82Å
450	R	66	Low	66	Low	220 Å²	220	55.1 Å²	55.1	83%	0.83	28%	0.275	S	S	*	.	S	Bend	trans	-112.3	-47.6	173.4	-55.7	177.7	176.7	-174.1	-2.3	110.4	E434	E434-R450 PolarHBondContact OE1-N 2.84Å; E434-R450 WeakPolarHBondContact OE2-CB 3.35Å; E434-R450 PolarHBondContact OE2-N 3.21Å
451	N	62.1	Low	65	Low	75 Å²	75	59.7 Å²	59.7	40%	0.401	29%	0.292	S	S	.	.	S	Bend	trans	-116.4	-26.4	-171.4	-72.9	-8.5	0	0	0	113.5	R341 E434 H437	R341-N451 PolarHBondContact NH1-O 3.18Å; E434-N451 PolarHBondContact OE1-N 2.85Å; E434-N451 WeakPolarHBondContact OE2-CB 3.38Å; E434-N451 PolarHBondContact OE2-N 3.07Å; H437-N451 PolarHBondContact CE1-ND2 2.88Å; H437-N451 WeakPolarHBondContact ND1-CB 3.3Å
452	A	60.8	Low	63.6	Low	5 Å²	5	66.1 Å²	66.1	4%	0.041	32%	0.317	C	S	.	.	S	Bend	trans	-85	155.5	177.8	0	0	0	0	0	111.9	A433 E434 G438 F440 T449	A433-A452 HydrophobicContact CB-CB 3.87Å; E434-A452 HydrophobicContact CG-CB 4.23Å; E434-A452 WeakPolarHBondContact OE1-CB 3.28Å; E434-A452 PolarHBondContact OE1-N 3.39Å; G438-A452 WeakPolarHBondContact O-CA 3.45Å; F440-A452 HydrophobicContact CB-CB 4.41Å; T449-A452 WeakPolarHBondContact CB-O 3.25Å; T449-A452 HydrophobicContact CG2-CB 4.14Å
453	I	63.1	Low	62	Low	14 Å²	14	68 Å²	68	7%	0.072	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.2	169.9	-54.3	155.4	0	0	0	108.1	C319 Y321 G438 V439 F440 F475	C319-I453 HydrophobicContact CB-CD1 3.55Å; C319-I453 VanDerWaalsContact SG-CD1 3.57Å; Y321-I453 VanDerWaalsContact OH-CD1 3.29Å; Y321-I453 WeakPolarHBondContact OH-CD1 3.33Å; Y321-I453 WeakPolarHBondContact OH-CG1 3.48Å; G438-I453 PolarHBondContact O-N 3.02Å; V439-I453 HydrophobicContact CG2-CB 4.47Å; V439-I453 HydrophobicContact CG2-CD1 3.95Å; F440-I453 PolarHBondContact N-O 3.29Å; I453-F475 HydrophobicContact CG2-CD1 3.73Å; I453-F475 HydrophobicContact CG2-CE1 4.42Å
454	Q	63.5	Low	60.9	Low	0 Å²	0	76.4 Å²	76.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.3	168.8	-177.6	165.2	3.6	0	0	111.6	F440 A444 T449 F456 L476	F440-Q454 HydrophobicContact CD1-CG 4.17Å; A444-Q454 PolarHBondContact O-NE2 3.08Å; T449-Q454 HydrophobicContact CG2-CB 4.4Å; Q454-F456 VanDerWaalsContact CD-CZ 3.49Å; Q454-F456 HydrophobicContact CG-CE1 4.38Å; Q454-F456 HydrophobicContact CG-CE2 3.98Å; Q454-F456 HydrophobicContact CG-CZ 3.88Å; Q454-L476 HydrophobicContact CB-CB 4.31Å; Q454-L476 PolarHBondContact O-N 3.13Å
455	C	66.9	Low	60.2	Low	0 Å²	0	81.8 Å²	81.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.9	-177.5	170.4	0	0	0	0	110.6	V439 F440 V441 S442 T473 V474 F475	V439-C455 HydrophobicContact CG1-CB 3.52Å; F440-C455 WeakPolarHBondContact O-CB 3.46Å; F440-C455 PolarHBondContact O-N 3.37Å; V441-C455 WeakPolarHBondContact CA-O 3.36Å; V441-C455 HydrophobicContact CG2-CB 4Å; S442-C455 PolarHBondContact N-O 3.09Å; S442-C455 VanDerWaalsContact N-O 3.1Å; C455-T473 WeakPolarHBondContact SG-CG2 3.34Å; C455-V474 WeakPolarHBondContact CA-O 3.36Å; C455-F475 HydrophobicContact CB-CD1 3.96Å; C455-F475 HydrophobicContact CB-CE1 3.66Å
456	F	65.8	Low	60	Low	36 Å²	36	77.7 Å²	77.7	16%	0.158	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.6	177.4	-52.3	-92.7	0	0	0	110.1	S442 Q454 V474 L476	S442-F456 WeakPolarHBondContact O-CD1 3.35Å; Q454-F456 VanDerWaalsContact CD-CZ 3.49Å; Q454-F456 HydrophobicContact CG-CE1 4.38Å; Q454-F456 HydrophobicContact CG-CE2 3.98Å; Q454-F456 HydrophobicContact CG-CZ 3.88Å; F456-V474 PolarHBondContact N-O 2.92Å; F456-V474 PolarHBondContact O-N 2.79Å; F456-L476 HydrophobicContact CE2-CB 3.95Å; F456-L476 HydrophobicContact CE2-CD1 3.75Å; F456-L476 HydrophobicContact CE2-CG 4.34Å; F456-L476 HydrophobicContact CZ-CD1 4.17Å
457	P	63.6	Low	59.4	Low	3 Å²	3	73.1 Å²	73.1	2%	0.019	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	119.7	165.3	0.5	16.5	0	0	0	109.1	F350 M353 I372 V441 I471	F350-P457 HydrophobicContact CD2-CB 4.39Å; F350-P457 HydrophobicContact CD2-CG 4.33Å; M353-P457 HydrophobicContact CE-CB 3.97Å; M353-P457 HydrophobicContact CE-CG 3.89Å; M353-P457 VanDerWaalsContact CE-O 3.22Å; M353-P457 WeakPolarHBondContact CE-O 3.43Å; I372-P457 HydrophobicContact CD1-CB 4.16Å; I372-P457 HydrophobicContact CD1-CG 3.79Å; V441-P457 HydrophobicContact CG1-CG 3.53Å; P457-I471 HydrophobicContact CB-CG2 3.96Å
458	V	61.2	Low	58.7	Low	60 Å²	60	73.5 Å²	73.5	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.6	171.3	179.2	0	0	0	0	108.6	C472 V474	V458-C472 HydrophobicContact CB-CB 4.44Å; V458-C472 PolarHBondContact N-O 3.46Å; V458-C472 PolarHBondContact O-N 3.14Å; V458-V474 HydrophobicContact CG2-CB 4.47Å; V458-V474 HydrophobicContact CG2-CG2 3.7Å
459	I	63.1	Low	58	Low	26 Å²	26	66 Å²	66	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	99.7	-177	-56.5	-168	0	0	0	110.9	F350 M353 L354 R461 F469 L470	F350-I459 HydrophobicContact CD2-CD1 4.02Å; F350-I459 HydrophobicContact CE2-CD1 3.56Å; F350-I459 HydrophobicContact CE2-CG1 4.29Å; F350-I459 HydrophobicContact CZ-CD1 4.22Å; M353-I459 HydrophobicContact CB-CD1 3.6Å; M353-I459 HydrophobicContact CB-CG1 4.2Å; M353-I459 HydrophobicContact CE-CD1 4.02Å; M353-I459 HydrophobicContact CE-CG1 4.12Å; M353-I459 HydrophobicContact SD-CD1 4.47Å; M353-I459 HydrophobicContact SD-CG1 4.29Å; L354-I459 HydrophobicContact CD1-CD1 4.37Å; L354-I459 HydrophobicContact CD2-CD1 3.74Å; L354-I459 HydrophobicContact CD2-CG2 4.01Å; L354-I459 HydrophobicContact CG-CD1 3.67Å; I459-R461 HydrophobicContact CG2-CG 4.1Å; I459-R461 PolarHBondContact O-N 3.36Å; I459-F469 HydrophobicContact CG2-CB 3.74Å; I459-F469 HydrophobicContact CG2-CD2 3.69Å; I459-F469 HydrophobicContact CG2-CG 3.83Å; I459-L470 WeakPolarHBondContact CA-O 3.48Å
460	N	54.5	Low	57.4	Low	81 Å²	81	68 Å²	68	43%	0.433	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	96.7	177.3	-73.2	-50.8	0	0	0	110.5	L470 C472	N460-L470 HydrophobicContact CB-CB 4.33Å; N460-L470 PolarHBondContact N-O 2.82Å; N460-L470 PolarHBondContact O-N 2.94Å; N460-C472 PolarHBondContact ND2-SG 2.91Å; N460-C472 VanDerWaalsContact ND2-SG 3.37Å
461	R	55.3	Low	56.7	Low	95 Å²	95	58.9 Å²	58.9	36%	0.358	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.7	176.8	-50.4	-166	-156.2	-160.6	9.9	111.1	M353 L354 I459 F469	M353-R461 PolarHBondContact O-NH2 2.96Å; L354-R461 VanDerWaalsContact CA-NH2 3.32Å; L354-R461 VanDerWaalsContact O-CZ 3.24Å; L354-R461 PolarHBondContact O-NH1 3.32Å; L354-R461 PolarHBondContact O-NH2 3.21Å; I459-R461 HydrophobicContact CG2-CG 4.1Å; I459-R461 PolarHBondContact O-N 3.36Å; R461-F469 HydrophobicContact CG-CB 4.07Å
462	Y	49.9	Very low	56.2	Low	136 Å²	136	57.9 Å²	57.9	53%	0.533	28%	0.276	S	S	.	.			trans	-98.4	4.9	174.3	56	-93.1	0	0	0	112.7	E468 L470	Y462-E468 HydrophobicContact CE2-CB 3.82Å; Y462-E468 HydrophobicContact CE2-CG 4.36Å; Y462-L470 HydrophobicContact CD1-CG 4.08Å; Y462-L470 HydrophobicContact CE1-CD2 4.32Å; Y462-L470 HydrophobicContact CE1-CG 4.01Å
463	S	48.6	Very low	55.8	Low	41 Å²	41	59.7 Å²	59.7	29%	0.287	29%	0.287	S	S	.	.	S	Bend	trans	-145.5	168.8	-175.9	-176.3	0	0	0	0	111.9	R465 E468	S463-R465 VanDerWaalsContact C-N 3.34Å; S463-R465 PolarHBondContact OG-N 2.63Å; S463-E468 WeakPolarHBondContact CB-OE2 3.31Å; S463-E468 PolarHBondContact OG-OE2 2.79Å
464	K	52.4	Low	55.2	Low	215 Å²	215	62.5 Å²	62.5	94%	0.935	30%	0.304	S	S	*	.	S	Bend	trans	-85.3	-5.4	171.1	-66.5	-170.9	176.7	-173.7	0	113.3
465	R	51.7	Low	54.8	Low	150 Å²	150	65.9 Å²	65.9	57%	0.566	32%	0.319	S	S	*	.	S	Bend	trans	-80.4	152.4	173.9	-70.9	-174.8	-177.8	142.2	1.7	111.1	S463 D467 E468	S463-R465 VanDerWaalsContact C-N 3.34Å; S463-R465 PolarHBondContact OG-N 2.63Å; R465-D467 VanDerWaalsContact C-N 3.28Å; R465-D467 WeakPolarHBondContact CB-OD1 3.45Å; R465-E468 HydrophobicContact CB-CB 4.22Å; R465-E468 HydrophobicContact CB-CG 4.28Å; R465-E468 WeakPolarHBondContact CD-OE1 3.44Å; R465-E468 IonicContact CZ-OE1 2.77Å; R465-E468 IonicContact NE-OE1 3.14Å; R465-E468 IonicContact NH1-OE1 3.84Å; R465-E468 PolarHBondContact NH1-OE1 2.8Å; R465-E468 IonicContact NH1-OE2 3.11Å
466	L	54.3	Low	53.9	Low	94 Å²	94	68.7 Å²	68.7	49%	0.492	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-20.4	177.7	-63	178.9	0	0	0	112.6	L354 F469	L354-L466 WeakPolarHBondContact O-CD2 3.13Å; L466-F469 VanDerWaalsContact O-CD1 3.25Å; L466-F469 WeakPolarHBondContact O-CD1 3.18Å; L466-F469 WeakPolarHBondContact O-CE1 3.34Å
467	D	48.9	Very low	52.9	Low	60 Å²	60	72.7 Å²	72.7	32%	0.321	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	23.3	-173	69.7	-54.7	0	0	0	113.4	R367 R465	R367-D467 IonicContact CZ-OD2 2.75Å; R367-D467 PolarHBondContact NH1-O 2.89Å; R367-D467 IonicContact NH1-OD2 3.81Å; R367-D467 PolarHBondContact NH1-OD2 3.07Å; R367-D467 PolarHBondContact NH2-O 3.09Å; R465-D467 VanDerWaalsContact C-N 3.28Å; R465-D467 WeakPolarHBondContact CB-OD1 3.45Å
468	E	51.8	Low	51.9	Low	43 Å²	43	75.5 Å²	75.5	20%	0.201	38%	0.376	C	S	.	.			trans	-134.6	75.9	179.5	-76	175.1	-179.1	0	0	110	Y462 S463 R465	Y462-E468 HydrophobicContact CE2-CB 3.82Å; Y462-E468 HydrophobicContact CE2-CG 4.36Å; S463-E468 WeakPolarHBondContact CB-OE2 3.31Å; S463-E468 PolarHBondContact OG-OE2 2.79Å; R465-E468 HydrophobicContact CB-CB 4.22Å; R465-E468 HydrophobicContact CB-CG 4.28Å; R465-E468 WeakPolarHBondContact CD-OE1 3.44Å; R465-E468 IonicContact CZ-OE1 2.77Å; R465-E468 IonicContact NE-OE1 3.14Å; R465-E468 IonicContact NH1-OE1 3.84Å; R465-E468 PolarHBondContact NH1-OE1 2.8Å; R465-E468 IonicContact NH1-OE2 3.11Å
469	F	51.4	Low	50.5	Low	15 Å²	15	79.9 Å²	79.9	7%	0.066	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.5	-178.7	63.2	-89.2	0	0	0	111.8	F350 L354 E371 I459 R461 L466 I471	F350-F469 HydrophobicContact CZ-CE2 4.34Å; F350-F469 HydrophobicContact CZ-CZ 4.47Å; L354-F469 HydrophobicContact CD1-CE1 4.49Å; L354-F469 HydrophobicContact CD1-CZ 4.24Å; L354-F469 HydrophobicContact CD2-CD1 3.7Å; L354-F469 HydrophobicContact CD2-CD2 4.3Å; L354-F469 HydrophobicContact CD2-CE1 3.56Å; L354-F469 HydrophobicContact CD2-CE2 4.16Å; L354-F469 HydrophobicContact CD2-CG 4.08Å; L354-F469 HydrophobicContact CD2-CZ 3.81Å; E371-F469 WeakPolarHBondContact OE2-CE1 3.32Å; E371-F469 WeakPolarHBondContact OE2-CZ 3.34Å; I459-F469 HydrophobicContact CG2-CB 3.74Å; I459-F469 HydrophobicContact CG2-CD2 3.69Å; I459-F469 HydrophobicContact CG2-CG 3.83Å; R461-F469 HydrophobicContact CG-CB 4.07Å; L466-F469 VanDerWaalsContact O-CD1 3.25Å; L466-F469 WeakPolarHBondContact O-CD1 3.18Å; L466-F469 WeakPolarHBondContact O-CE1 3.34Å; F469-I471 HydrophobicContact CD2-CG1 4.09Å; F469-I471 HydrophobicContact CE2-CD1 4.12Å; F469-I471 HydrophobicContact CE2-CG1 3.74Å
470	L	49.6	Very low	49.2	Very low	60 Å²	60	84.4 Å²	84.4	31%	0.314	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.6	168.9	-62.4	173.5	0	0	0	109.2	I459 N460 Y462	I459-L470 WeakPolarHBondContact CA-O 3.48Å; N460-L470 HydrophobicContact CB-CB 4.33Å; N460-L470 PolarHBondContact N-O 2.82Å; N460-L470 PolarHBondContact O-N 2.94Å; Y462-L470 HydrophobicContact CD1-CG 4.08Å; Y462-L470 HydrophobicContact CE1-CD2 4.32Å; Y462-L470 HydrophobicContact CE1-CG 4.01Å
471	I	51.9	Low	48.1	Very low	28 Å²	28	84.9 Å²	84.9	14%	0.144	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.8	167.5	-54.8	177.3	0	0	0	107.4	F350 E371 I372 P457 F469	F350-I471 HydrophobicContact CE2-CD1 4.05Å; F350-I471 HydrophobicContact CZ-CD1 4.04Å; E371-I471 HydrophobicContact CB-CD1 4.47Å; I372-I471 HydrophobicContact CB-CD1 3.79Å; I372-I471 HydrophobicContact CG1-CD1 4.26Å; P457-I471 HydrophobicContact CB-CG2 3.96Å; F469-I471 HydrophobicContact CD2-CG1 4.09Å; F469-I471 HydrophobicContact CE2-CD1 4.12Å; F469-I471 HydrophobicContact CE2-CG1 3.74Å
472	C	51.6	Low	46.9	Very low	54 Å²	54	90.2 Å²	90.2	37%	0.365	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.7	168.6	-58.2	0	0	0	0	108.8	V458 N460	V458-C472 HydrophobicContact CB-CB 4.44Å; V458-C472 PolarHBondContact N-O 3.46Å; V458-C472 PolarHBondContact O-N 3.14Å; N460-C472 PolarHBondContact ND2-SG 2.91Å; N460-C472 VanDerWaalsContact ND2-SG 3.37Å
473	T	52.6	Low	46	Very low	43 Å²	43	93 Å²	93	26%	0.264	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.5	-172.9	-43.8	0	0	0	0	110.9	N375 F376 C455 F475	N375-T473 PolarHBondContact ND2-OG1 3.19Å; N375-T473 VanDerWaalsContact ND2-OG1 3.12Å; F376-T473 HydrophobicContact CE1-CG2 4.01Å; F376-T473 HydrophobicContact CZ-CG2 4.19Å; C455-T473 WeakPolarHBondContact SG-CG2 3.34Å; T473-F475 HydrophobicContact CG2-CE1 4.33Å; T473-F475 HydrophobicContact CG2-CE2 3.75Å; T473-F475 HydrophobicContact CG2-CZ 3.48Å; T473-F475 VanDerWaalsContact CG2-CZ 3.48Å
474	V	51.6	Low	45.2	Very low	72 Å²	72	97.1 Å²	97.1	44%	0.436	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.2	178.6	-177.9	0	0	0	0	110.2	C455 F456 V458	C455-V474 WeakPolarHBondContact CA-O 3.36Å; F456-V474 PolarHBondContact N-O 2.92Å; F456-V474 PolarHBondContact O-N 2.79Å; V458-V474 HydrophobicContact CG2-CB 4.47Å; V458-V474 HydrophobicContact CG2-CG2 3.7Å
475	F	54.1	Low	44	Very low	72 Å²	72	94.8 Å²	94.8	32%	0.316	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.4	178.6	-65.3	-76.9	0	0	0	111.1	L317 V439 I453 C455 T473 V477	L317-F475 HydrophobicContact CD1-CZ 4.19Å; L317-F475 HydrophobicContact CD2-CE1 3.98Å; L317-F475 HydrophobicContact CD2-CE2 4.5Å; L317-F475 HydrophobicContact CD2-CZ 3.67Å; L317-F475 HydrophobicContact CG-CE1 4.35Å; L317-F475 HydrophobicContact CG-CE2 4.32Å; L317-F475 HydrophobicContact CG-CZ 3.6Å; V439-F475 HydrophobicContact CG1-CE1 4.19Å; I453-F475 HydrophobicContact CG2-CD1 3.73Å; I453-F475 HydrophobicContact CG2-CE1 4.42Å; C455-F475 HydrophobicContact CB-CD1 3.96Å; C455-F475 HydrophobicContact CB-CE1 3.66Å; T473-F475 HydrophobicContact CG2-CE1 4.33Å; T473-F475 HydrophobicContact CG2-CE2 3.75Å; T473-F475 HydrophobicContact CG2-CZ 3.48Å; T473-F475 VanDerWaalsContact CG2-CZ 3.48Å; F475-V477 PolarHBondContact O-N 2.91Å
476	L	48.5	Very low	43	Very low	59 Å²	59	91.5 Å²	91.5	31%	0.309	49%	0.489	S	S	.	.			trans	-75.2	123.8	166.3	-148.1	71.8	0	0	0	108.6	Q454 F456 N478	Q454-L476 HydrophobicContact CB-CB 4.31Å; Q454-L476 PolarHBondContact O-N 3.13Å; F456-L476 HydrophobicContact CE2-CB 3.95Å; F456-L476 HydrophobicContact CE2-CD1 3.75Å; F456-L476 HydrophobicContact CE2-CG 4.34Å; F456-L476 HydrophobicContact CZ-CD1 4.17Å; L476-N478 PolarHBondContact O-N 2.85Å; L476-N478 VanDerWaalsContact O-N 3.14Å
477	V	45.2	Very low	41.8	Very low	120 Å²	120	95.3 Å²	95.3	73%	0.727	50%	0.504	S	S	*	.			trans	-75.9	99.1	161.1	179.7	0	0	0	0	106.3	F475 N479	F475-V477 PolarHBondContact O-N 2.91Å; V477-N479 PolarHBondContact O-N 2.79Å
478	N	41.2	Very low	40.8	Very low	61 Å²	61	99.5 Å²	99.5	33%	0.326	53%	0.526	S	S	.	.			trans	-59.8	100.5	177.3	-83.2	0.3	0	0	0	110	T449 L476 L480	T449-N478 PolarHBondContact OG1-ND2 2.82Å; L476-N478 PolarHBondContact O-N 2.85Å; L476-N478 VanDerWaalsContact O-N 3.14Å; N478-L480 PolarHBondContact O-N 2.88Å
479	N	32.6	Very low	39.6	Very low	152 Å²	152	106.1 Å²	106.1	81%	0.813	56%	0.555	S	S	*	*			trans	-70.6	75.7	167.8	-77	-53.5	0	0	0	109.2	V477	V477-N479 PolarHBondContact O-N 2.79Å
480	L	35.3	Very low	38.4	Very low	121 Å²	121	112.4 Å²	112.4	63%	0.634	59%	0.594	S	S	*	*			trans	-47.6	122.6	171.9	-97.9	156.2	0	0	0	109.3	N478 K482	N478-L480 PolarHBondContact O-N 2.88Å; L480-K482 PolarHBondContact O-N 2.67Å; L480-K482 VanDerWaalsContact O-N 3.11Å
481	P	30.8	Very low	37.4	Very low	91 Å²	91	116.7 Å²	116.7	59%	0.591	61%	0.613	S	S	*	*			trans	-61.7	121	178.3	23.9	-32.6	0	0	0	108.8	K483	P481-K483 PolarHBondContact O-N 3.37Å
482	K	31.6	Very low	36.2	Very low	207 Å²	207	123.3 Å²	123.3	90%	0.9	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	11.6	-168.7	-63.9	-173.6	174.6	-174.6	0	116.6	L480	L480-K482 PolarHBondContact O-N 2.67Å; L480-K482 VanDerWaalsContact O-N 3.11Å
483	K	29.3	Very low	35.1	Very low	194 Å²	194	125.7 Å²	125.7	84%	0.843	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-9.4	-176.4	-81.4	-167.4	169.4	-171.9	0	115.5	P481	P481-K483 PolarHBondContact O-N 3.37Å
484	I	32.4	Very low	33.8	Very low	129 Å²	129	134.1 Å²	134.1	66%	0.662	69%	0.687	S	S	*	*	S	Bend	trans	-96.5	-27.1	-175.4	-57.6	179.2	0	0	0	112.5	A486	I484-A486 PolarHBondContact O-N 3.25Å; I484-A486 VanDerWaalsContact O-N 3.09Å
485	L	28.4	Very low	32.6	Very low	166 Å²	166	137.3 Å²	137.3	87%	0.869	71%	0.706	S	S	*	*	S	Bend	trans	-80.7	22.5	-178.2	-93.7	165.7	0	0	0	114.8
486	A	29.2	Very low	31.2	Very low	81 Å²	81	141.8 Å²	141.8	67%	0.669	73%	0.733	S	S	*	*	S	Bend	trans	-121.2	19.6	-165.9	0	0	0	0	0	114.8	I484	I484-A486 PolarHBondContact O-N 3.25Å; I484-A486 VanDerWaalsContact O-N 3.09Å
487	Q	29.6	Very low	30.1	Very low	173 Å²	173	148.3 Å²	148.3	81%	0.808	76%	0.758	S	S	*	*	S	Bend	trans	-135.3	-27.8	-174.4	-117.4	172	-31.5	0	0	117.3
488	D	29.1	Very low	29.3	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	76%	0.761	S	S	*	*	S	Bend	trans	-116.3	24	-169.7	-62.5	-57.7	0	0	0	115.5
489	F	25.8	Very low	28.4	Very low	182 Å²	182	154.7 Å²	154.7	80%	0.798	79%	0.789	S	S	*	*			trans	-136.3	95.6	169.1	-94	-89	0	0	0	111.7	E491	F489-E491 HydrophobicContact CD1-CG 4.13Å
490	V	26.9	Very low	28	Very low	147 Å²	147	150.8 Å²	150.8	89%	0.891	78%	0.784	S	S	*	*			trans	-122	97.7	158.7	178	0	0	0	0	106.5
491	E	28	Very low	27.5	Very low	150 Å²	150	150.3 Å²	150.3	70%	0.701	79%	0.791	S	S	*	*			trans	-77.6	130	177.7	-65.4	-176	122.4	0	0	110.8	F489 S493	F489-E491 HydrophobicContact CD1-CG 4.13Å; E491-S493 PolarHBondContact O-N 3.43Å
492	E	25.9	Very low	27.1	Very low	166 Å²	166	151 Å²	151	78%	0.776	80%	0.799	S	S	*	*			trans	-69.7	74.1	166.7	-75.9	-156.7	138.5	0	0	111	R494	E492-R494 VanDerWaalsContact C-N 3.31Å; E492-R494 PolarHBondContact O-N 2.62Å
493	S	28.8	Very low	26.8	Very low	104 Å²	104	146.8 Å²	146.8	73%	0.727	80%	0.795	S	S	*	*			trans	-71.4	84.8	171.1	42.5	0	0	0	0	110.7	E491 V495	E491-S493 PolarHBondContact O-N 3.43Å; S493-V495 PolarHBondContact O-N 3.15Å
494	R	25.6	Very low	26.5	Very low	221 Å²	221	141.6 Å²	141.6	83%	0.834	79%	0.788	S	S	*	*			trans	-62.2	122.8	177.8	-66	-179.6	179.6	178.8	0.1	111.6	E492	E492-R494 VanDerWaalsContact C-N 3.31Å; E492-R494 PolarHBondContact O-N 2.62Å
495	V	25.9	Very low	26.1	Very low	139 Å²	139	141.5 Å²	141.5	84%	0.842	79%	0.793	S	S	*	*			trans	-124.8	154.1	166	-177.4	0	0	0	0	109.1	S493	S493-V495 PolarHBondContact O-N 3.15Å
496	L	25.1	Very low	25.9	Very low	166 Å²	166	138.7 Å²	138.7	87%	0.869	79%	0.788	S	S	*	*			trans	-82.3	144.5	-162.1	-71.4	140.1	0	0	0	115
497	K	25.4	Very low	25.6	Very low	195 Å²	195	139.8 Å²	139.8	85%	0.848	79%	0.791	S	S	*	*			trans	-9	144.3	154.2	-85.4	-176.8	177.3	-177.5	0	118
498	P	27.5	Very low	25.3	Very low	120 Å²	120	137.4 Å²	137.4	78%	0.779	79%	0.788	S	S	*	*				-139.3	160.2	76.7	37.3	-21.7	0	0	0	118.6
499	E	24	Very low	25.1	Very low	195 Å²	195	136.5 Å²	136.5	91%	0.911	79%	0.788	S	S	*	*			trans	27.9	134.7	153.2	-55.9	-172.6	161.1	0	0	123
500	G	23.9	Very low	25	Very low	70 Å²	70	133.6 Å²	133.6	72%	0.722	79%	0.785	S	S	*	*			trans	170	60.1	173.2	0	0	0	0	0	118.5
501	S	23.9	Very low	24.9	Very low	111 Å²	111	133 Å²	133	78%	0.776	78%	0.776	S	S	*	*			trans	28.8	115.3	156.8	59.8	0	0	0	0	123.1
502	S	23.4	Very low	24.7	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	78%	0.783	S	S	*	*				91.5	137.6	127	78.7	0	0	0	0	123.6
503	S	24	Very low	24.5	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	78%	0.783	S	S	*	*			trans	70.9	151.9	160.7	76.2	0	0	0	0	119.7
504	A	23.8	Very low	24.4	Very low	85 Å²	85	135.5 Å²	135.5	70%	0.702	79%	0.79	S	S	*	*			cis	-169.7	165.4	-32.1	0	0	0	0	0	109.9
505	V	23.9	Very low	24.3	Very low	126 Å²	126	132.8 Å²	132.8	76%	0.764	79%	0.786	S	S	*	*			trans	67.6	100.2	165.8	-172.1	0	0	0	0	115.4
506	S	23.6	Very low	24.3	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	79%	0.791	S	S	*	*				70.2	143	97.9	-46.3	0	0	0	0	115
507	S	24.4	Very low	24.3	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	79%	0.788	S	S	*	*			cis	-152.9	160.6	32.8	-47.3	0	0	0	0	114.7
508	T	22.8	Very low	24.3	Very low	123 Å²	123	135 Å²	135	76%	0.755	79%	0.787	S	S	*	*			trans	-8.1	149.7	151.5	48.4	0	0	0	0	118.7
509	T	24.8	Very low	24.2	Very low	129 Å²	129	134.5 Å²	134.5	79%	0.791	79%	0.786	S	S	*	*			cis	-167	176.4	37.2	-13	0	0	0	0	108.3
510	V	24.1	Very low	24.2	Very low	121 Å²	121	128.7 Å²	128.7	73%	0.733	78%	0.778	S	S	*	*			cis	-145.6	-104.8	5.6	57.5	0	0	0	0	113.7
511	L	23.6	Very low	24.3	Very low	136 Å²	136	130 Å²	130	71%	0.712	78%	0.782	S	S	*	*			trans	-155.4	177.2	-163.7	-62	169.5	0	0	0	107.5
512	E	24.2	Very low	24.4	Very low	181 Å²	181	131.7 Å²	131.7	85%	0.846	78%	0.779	S	S	*	*			cis	-130.4	147.7	8.1	-59.2	164.4	131.5	0	0	107
513	E	23	Very low	24.6	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	78%	0.775	S	S	*	*			cis	72.7	100.9	46.1	-146.4	178.9	-130.7	0	0	115.7
514	S	24.8	Very low	24.7	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	77%	0.772	S	S	*	*			trans	-155	116.9	142.1	52	0	0	0	0	110.8
515	H	24.4	Very low	25	Very low	164 Å²	164	135.4 Å²	135.4	76%	0.759	77%	0.774	S	S	*	*			trans	-104	144.3	170.7	-84.6	-65.7	0	0	0	110.2
516	Q	25.3	Very low	25.2	Very low	203 Å²	203	138.3 Å²	138.3	95%	0.949	78%	0.779	S	S	*	*			trans	-131.7	149.5	144.7	-83	-169	-19.1	0	0	110.2
517	K	25.2	Very low	25.4	Very low	183 Å²	183	141.2 Å²	141.2	80%	0.796	79%	0.786	S	S	*	*			trans	-166.4	174.3	-161.5	-166.9	179.7	179.7	-177.6	0	108.4
518	I	26.8	Very low	25.5	Very low	161 Å²	161	144.9 Å²	144.9	83%	0.826	79%	0.792	S	S	*	*			trans	81.1	136.9	171.4	-50.6	161.1	0	0	0	111.7
519	S	25.2	Very low	26.5	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	79%	0.791	S	S	*	*			cis	-143.4	171.4	-1.8	36.9	0	0	0	0	108.8
520	G	23.6	Very low	26.6	Very low	73 Å²	73	143.1 Å²	143.1	75%	0.753	79%	0.793	S	S	*	*			cis	107	133.8	14.2	0	0	0	0	0	111.5
521	A	25	Very low	26.5	Very low	97 Å²	97	144.6 Å²	144.6	80%	0.802	80%	0.797	S	S	*	*			cis	-115	-109.8	0.2	0	0	0	0	0	113.6
522	M	25.9	Very low	27.4	Very low	146 Å²	146	142.4 Å²	142.4	72%	0.719	79%	0.791	S	S	*	*			cis	-164.6	147.6	1.8	-161.4	157.5	176.9	0	0	112.6
523	E	28.8	Very low	27.4	Very low	142 Å²	142	141.8 Å²	141.8	66%	0.664	79%	0.788	S	S	*	*			trans	5.5	151.6	154	-63.5	152.5	-148.3	0	0	122.3
524	D	26.5	Very low	27.5	Very low	139 Å²	139	139 Å²	139	74%	0.743	78%	0.783	S	S	*	*			cis	-170	-179.8	-8.4	-108.6	-2.8	0	0	0	113.2
525	S	28.5	Very low	27.4	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	78%	0.777	S	S	*	*			trans	70.3	126.1	172.6	62.3	0	0	0	0	117.4
526	E	29.2	Very low	27.4	Very low	187 Å²	187	139.9 Å²	139.9	87%	0.874	78%	0.775	S	S	*	*			cis	90.2	106.1	39.4	-72.4	-166.3	160.6	0	0	114.9
527	D	27.4	Very low	27.4	Very low	169 Å²	169	136 Å²	136	90%	0.904	76%	0.757	S	S	*	*				-169.6	146.6	127.1	-113.7	-28.1	0	0	0	111.4
528	E	26.8	Very low	27.3	Very low	182 Å²	182	133.9 Å²	133.9	85%	0.85	75%	0.75	S	S	*	*			trans	-108.9	-144.6	175.4	-79.6	-153.1	142	0	0	112.2
529	P	43.7	Very low	27.3	Very low	112 Å²	112	136 Å²	136	73%	0.727	75%	0.749	S	S	*	*				-126.3	175.3	-97.8	39.4	-24.3	0	0	0	114.6
530	A	25.9	Very low	27.1	Very low	103 Å²	103	137.8 Å²	137.8	85%	0.851	75%	0.749	S	S	*	*			trans	-163.2	150.4	148.1	0	0	0	0	0	113
531	D	23.9	Very low	27.2	Very low	152 Å²	152	140.7 Å²	140.7	81%	0.813	75%	0.746	S	S	*	*			trans	-111.9	-150.7	174.8	-165.7	33.7	0	0	0	109.8
532	P	41.3	Very low	27.1	Very low	90 Å²	90	143.5 Å²	143.5	58%	0.584	74%	0.74	S	S	*	*				-113.8	-166	-111.9	39.8	-26.4	0	0	0	116.3
533	Q	24.4	Very low	27.1	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	74%	0.737	S	S	*	*			trans	114.6	103.7	137.6	-95.4	176.9	38.5	0	0	121.6
534	T	24.3	Very low	26.8	Very low	109 Å²	109	145.1 Å²	145.1	67%	0.669	75%	0.746	S	S	*	*				78.2	127.4	128.2	44.3	0	0	0	0	125.3
535	L	24.1	Very low	26.6	Very low	141 Å²	141	144.1 Å²	144.1	74%	0.738	75%	0.748	S	S	*	*			trans	87.1	126.8	131.2	-74.7	166.3	0	0	0	122.6
536	K	24.6	Very low	26.4	Very low	165 Å²	165	145 Å²	145	72%	0.717	75%	0.754	S	S	*	*			trans	75.2	156.1	145.1	-68.1	168.4	155.8	-143	0	117.7
537	Q	24.7	Very low	26.2	Very low	122 Å²	122	145 Å²	145	57%	0.57	75%	0.754	S	S	*	*			cis	-155.8	145.2	-3	-128.1	166.6	-96.5	0	0	112.3
538	E	23.6	Very low	26.1	Very low	138 Å²	138	144.4 Å²	144.4	65%	0.645	75%	0.75	S	S	*	*			trans	58.9	169.2	141	-76.4	165.8	167.9	0	0	124.6
539	Y	25.4	Very low	26	Very low	207 Å²	207	140 Å²	140	81%	0.812	74%	0.739	S	S	*	*			trans	70.8	113	176.4	-61.7	-81.1	0	0	0	117.1
540	L	22	Very low	25.2	Very low	146 Å²	146	142.6 Å²	142.6	76%	0.764	74%	0.741	S	S	*	*			cis	95.4	138	18	-155	92.2	0	0	0	115.3
541	I	24.5	Very low	25.1	Very low	134 Å²	134	144.6 Å²	144.6	69%	0.687	74%	0.738	S	S	*	*			trans	99.6	116.1	158.2	-89.1	167.7	0	0	0	121
542	K	24.8	Very low	25.4	Very low	156 Å²	156	141.6 Å²	141.6	68%	0.678	73%	0.728	S	S	*	*			trans	71.4	134.6	144.8	-70.1	-173.5	172	-85.9	0	120.3
543	E	24.5	Very low	24.8	Very low	141 Å²	141	144.9 Å²	144.9	66%	0.659	74%	0.736	S	S	*	*				67.6	143.6	68.3	-60	169.3	170.9	0	0	111.9
544	E	23.4	Very low	24.9	Very low	180 Å²	180	146.2 Å²	146.2	84%	0.841	74%	0.742	S	S	*	*			cis	-151.8	-168.3	28.3	-152.5	162.2	-160.4	0	0	113.1
545	C	22.3	Very low	24.9	Very low	119 Å²	119	144.7 Å²	144.7	80%	0.804	75%	0.748	S	S	*	*			trans	-84	168.3	-168.1	-58.1	0	0	0	0	116.7
546	S	24.6	Very low	24.8	Very low	125 Å²	125	142.6 Å²	142.6	87%	0.874	75%	0.751	S	S	*	*			trans	-156.1	156.8	154	-71.7	0	0	0	0	110.7
547	E	24.6	Very low	24.9	Very low	186 Å²	186	142 Å²	142	87%	0.869	75%	0.754	S	S	*	*			trans	-110.7	-150.8	-170.7	-56.2	174.4	120	0	0	112.2
548	I	24.3	Very low	24.9	Very low	158 Å²	158	142.1 Å²	142.1	81%	0.81	76%	0.763	S	S	*	*			trans	81.9	139.3	170.6	-52	169.7	0	0	0	114.6
549	S	25.2	Very low	24.9	Very low	89 Å²	89	142.3 Å²	142.3	62%	0.622	77%	0.768	S	S	*	*				-179.6	-166.7	-50.4	49.5	0	0	0	0	107.9
550	E	26.9	Very low	24.8	Very low	166 Å²	166	139.3 Å²	139.3	78%	0.776	77%	0.771	S	S	*	*			trans	72.6	145.7	166.1	-62.5	169.2	-151.1	0	0	118.1
551	D	24.8	Very low	25	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	77%	0.768	S	S	*	*			cis	-166.2	-179.3	-35.7	-125.8	-35.1	0	0	0	112.3
552	S	28.3	Very low	25	Very low	88 Å²	88	135 Å²	135	62%	0.615	77%	0.771	S	S	*	*			trans	68.9	153.7	161.9	-61.2	0	0	0	0	119.2
553	E	30	Very low	24.9	Very low	160 Å²	160	133.1 Å²	133.1	75%	0.748	78%	0.777	S	S	*	*			cis	-160.7	132.2	-20.6	-107.9	154.6	-122.4	0	0	105.9
554	E	25.8	Very low	24.8	Very low	195 Å²	195	132.1 Å²	132.1	91%	0.911	79%	0.785	S	S	*	*				72.8	133.5	81.9	-163.5	163	-120.7	0	0	116
555	G	25	Very low	24.8	Very low	77 Å²	77	127.6 Å²	127.6	79%	0.794	79%	0.787	S	S	*	*			trans	169.3	123.3	175.8	0	0	0	0	0	116.2
556	A	22.5	Very low	24.8	Very low	96 Å²	96	129 Å²	129	79%	0.793	79%	0.787	S	S	*	*			trans	-156.5	176.3	-179.2	0	0	0	0	0	110.2
557	I	24.9	Very low	24.9	Very low	154 Å²	154	130.4 Å²	130.4	79%	0.79	78%	0.784	S	S	*	*			cis	-131.6	-143.5	7.6	-14	174.7	0	0	0	108.4
558	V	25.7	Very low	24.9	Very low	124 Å²	124	126.4 Å²	126.4	75%	0.752	78%	0.776	S	S	*	*			cis	-152.6	162.9	8.9	-143.1	0	0	0	0	109.9
559	D	22.9	Very low	25	Very low	141 Å²	141	127.2 Å²	127.2	75%	0.754	78%	0.776	S	S	*	*			trans	-67.6	166.6	168.5	-55.2	-90.9	0	0	0	114.7
560	V	24.7	Very low	25	Very low	144 Å²	144	130 Å²	130	87%	0.873	79%	0.785	S	S	*	*				179.3	144.9	110.2	151.7	0	0	0	0	110.5
561	A	24.3	Very low	25	Very low	85 Å²	85	133.7 Å²	133.7	70%	0.702	79%	0.791	S	S	*	*			trans	-107.5	169.2	-174.6	0	0	0	0	0	113.8
562	S	24.4	Very low	25.1	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	79%	0.793	S	S	*	*				162.6	135	123	-73.8	0	0	0	0	115
563	S	22.8	Very low	25	Very low	116 Å²	116	139.2 Å²	139.2	81%	0.811	81%	0.808	S	S	*	*			trans	62.2	160.7	150.5	69.6	0	0	0	0	118.7
564	S	23.4	Very low	24.9	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	81%	0.808	S	S	*	*			cis	-170.7	142.4	-25.2	49.1	0	0	0	0	107.8
565	G	24	Very low	25	Very low	85 Å²	85	135.5 Å²	135.5	88%	0.876	80%	0.799	S	S	*	*			trans	-174.8	123.1	176.5	0	0	0	0	0	113.1
566	D	22.3	Very low	25.2	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	79%	0.792	S	S	*	*			trans	-111.5	166.8	-162.6	-151.8	-15.7	0	0	0	112.4
567	L	25.1	Very low	25.5	Very low	155 Å²	155	141.4 Å²	141.4	81%	0.812	80%	0.795	S	S	*	*			trans	67.9	136.7	169.2	-49.7	166	0	0	0	116.3
568	S	25.6	Very low	25.5	Very low	102 Å²	102	141.4 Å²	141.4	71%	0.713	79%	0.792	S	S	*	*			cis	-176.4	149.5	42.6	51.4	0	0	0	0	114.3
569	E	26.6	Very low	25.6	Very low	175 Å²	175	144.4 Å²	144.4	82%	0.818	80%	0.797	S	S	*	*			trans	49.2	101.2	144.2	-57.8	-166.5	138.8	0	0	124.3
570	N	25.7	Very low	25.8	Very low	149 Å²	149	145.5 Å²	145.5	80%	0.797	80%	0.796	S	S	*	*				40.8	114.7	122.3	-59.8	-29.4	0	0	0	122.2
571	R	26.2	Very low	25.8	Very low	243 Å²	243	148 Å²	148	92%	0.917	80%	0.798	S	S	*	*				-168.2	150.1	108.3	-109.9	174.8	177.7	172.7	1	114.2
572	D	27.6	Very low	26	Very low	150 Å²	150	152.9 Å²	152.9	80%	0.802	80%	0.799	S	S	*	*			trans	-79.5	149.4	-173.8	-41	-106	0	0	0	114.4
573	Q	26.3	Very low	26.1	Very low	200 Å²	200	151 Å²	151	94%	0.935	79%	0.787	S	S	*	*				-168.2	161.3	111.9	-103.1	171.5	15.6	0	0	114.1
574	K	28.1	Very low	26.6	Very low	171 Å²	171	151.5 Å²	151.5	74%	0.743	79%	0.787	S	S	*	*			trans	-77.6	148.3	-167	-65.3	172.7	150.3	-152.6	0	115.7	E576	K574-E576 WeakPolarHBondContact CE-OE1 3.32Å; K574-E576 IonicContact NZ-OE1 2.85Å; K574-E576 PolarHBondContact NZ-OE1 3.5Å
575	S	27.3	Very low	27.1	Very low	105 Å²	105	152.5 Å²	152.5	73%	0.734	78%	0.778	S	S	*	*				-165.4	97.8	120.7	57.7	0	0	0	0	108.9
576	E	29.2	Very low	27.5	Very low	138 Å²	138	153.8 Å²	153.8	65%	0.645	76%	0.761	S	S	*	*				56	71.5	92.7	-72.9	169.5	-168.6	0	0	113.6	K574	K574-E576 WeakPolarHBondContact CE-OE1 3.32Å; K574-E576 IonicContact NZ-OE1 2.85Å; K574-E576 PolarHBondContact NZ-OE1 3.5Å
577	N	27.8	Very low	28	Very low	160 Å²	160	151.2 Å²	151.2	86%	0.856	75%	0.747	S	S	*	*			trans	-78.4	107	148	-80	-13.1	0	0	0	107.5	E579	N577-E579 PolarHBondContact O-N 3.21Å; N577-E579 VanDerWaalsContact O-N 3.1Å
578	E	26.5	Very low	28.5	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	73%	0.73	S	S	*	*			trans	-75.4	93.1	170.5	-68.9	-170.6	129.2	0	0	110.1	F580	E578-F580 WeakPolarHBondContact O-CD2 3.46Å; E578-F580 PolarHBondContact O-N 3.14Å
579	E	27.9	Very low	28.8	Very low	187 Å²	187	148 Å²	148	87%	0.874	72%	0.724	S	S	*	*			trans	-66.2	111.5	158.7	-72.6	-166.4	132.6	0	0	108.4	N577 E581	N577-E579 PolarHBondContact O-N 3.21Å; N577-E579 VanDerWaalsContact O-N 3.1Å; E579-E581 PolarHBondContact O-N 3.42Å
580	F	25.4	Very low	29	Very low	164 Å²	164	145.7 Å²	145.7	72%	0.719	71%	0.714	S	S	*	*			trans	-65.7	107.3	-178.4	-78.7	-98	0	0	0	111	E578 Y582	E578-F580 WeakPolarHBondContact O-CD2 3.46Å; E578-F580 PolarHBondContact O-N 3.14Å; F580-Y582 PolarHBondContact O-N 2.97Å
581	E	25.3	Very low	29.5	Very low	195 Å²	195	143.7 Å²	143.7	91%	0.911	70%	0.7	S	S	*	*			trans	-61.2	103.1	169.1	-79.6	-160.6	127.1	0	0	110.5	E579 S583	E579-E581 PolarHBondContact O-N 3.42Å; E581-S583 PolarHBondContact O-N 3.14Å
582	Y	28.4	Very low	30	Very low	188 Å²	188	134 Å²	134	74%	0.737	67%	0.665	S	S	*	*			trans	-62.2	126.2	174.3	-70.3	-75.1	0	0	0	110.9	F580	F580-Y582 PolarHBondContact O-N 2.97Å
583	S	27.6	Very low	30.3	Very low	68 Å²	68	127.5 Å²	127.5	48%	0.476	63%	0.63	S	S	.	*			trans	-58.1	137.8	-174.5	-174.4	0	0	0	0	112.1	E581 H585 Q586	E581-S583 PolarHBondContact O-N 3.14Å; S583-H585 PolarHBondContact O-N 2.9Å; S583-Q586 WeakPolarHBondContact O-CB 3.42Å; S583-Q586 PolarHBondContact O-N 3.11Å
584	P	32.4	Very low	30.8	Very low	125 Å²	125	126 Å²	126	81%	0.812	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	28.1	176.4	31.9	-37.9	0	0	0	113.5
585	H	34.4	Very low	31.2	Very low	140 Å²	140	122.1 Å²	122.1	65%	0.648	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	0.1	171.7	-65.5	4.1	0	0	0	111.6	R260 S583	R260-H585 PolarHBondContact NH2-CE1 3.27Å; R260-H585 VanDerWaalsContact NH2-CE1 3.34Å; R260-H585 PolarHBondContact NH2-NE2 2.8Å; R260-H585 VanDerWaalsContact NH2-NE2 3.17Å; S583-H585 PolarHBondContact O-N 2.9Å
586	Q	30.8	Very low	31.6	Very low	113 Å²	113	118.4 Å²	118.4	53%	0.528	58%	0.576	S	S	.	*	S	Bend	trans	-85.4	127.1	174.9	-153.6	161.9	-9.1	0	0	109.9	S583	S583-Q586 WeakPolarHBondContact O-CB 3.42Å; S583-Q586 PolarHBondContact O-N 3.11Å
587	L	32.9	Very low	31.9	Very low	93 Å²	93	113 Å²	113	49%	0.487	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-65.1	144.4	172	-72.5	165.3	0	0	0	109.3	Q592 L595	L587-Q592 HydrophobicContact CB-CG 3.51Å; L587-Q592 HydrophobicContact CD1-CG 4.38Å; L587-Q592 PolarHBondContact O-NE2 3.45Å; L587-L595 HydrophobicContact CD1-CD2 4.45Å
588	T	35.6	Very low	32.2	Very low	74 Å²	74	107.7 Å²	107.7	45%	0.454	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-65.3	152.1	178.1	70	0	0	0	0	111.1	E590 Q591 Q592	T588-E590 PolarHBondContact O-N 3.16Å; T588-E590 VanDerWaalsContact O-N 3.1Å; T588-Q591 PolarHBondContact O-N 3.05Å; T588-Q591 WeakPolarHBondContact OG1-CB 3.28Å; T588-Q591 VanDerWaalsContact OG1-CG 3.24Å; T588-Q591 WeakPolarHBondContact OG1-CG 3.38Å; T588-Q591 PolarHBondContact OG1-N 3.4Å; T588-Q592 WeakPolarHBondContact O-CG 3.34Å; T588-Q592 PolarHBondContact O-N 3.18Å
589	L	31.9	Very low	32.7	Very low	115 Å²	115	105.3 Å²	105.3	60%	0.602	52%	0.519	S	S	*	.	H	α-helix	trans	-50.6	-39.7	-178.4	-155	82.4	0	0	0	112.3	T593 L627	L589-T593 WeakPolarHBondContact O-CB 3.14Å; L589-T593 PolarHBondContact O-N 2.99Å; L589-T593 PolarHBondContact O-OG1 2.82Å; L589-L627 HydrophobicContact CD1-CD2 3.48Å; L589-L627 VanDerWaalsContact CD1-CD2 3.48Å; L589-L627 HydrophobicContact CD1-CG 4.37Å; L589-L627 HydrophobicContact CD2-CD2 4.46Å; L589-L627 HydrophobicContact CG-CD2 3.7Å
590	E	32.3	Very low	33	Very low	127 Å²	127	96.8 Å²	96.8	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-70.3	-43.2	176.5	-175.8	163.3	-115.9	0	0	113	T588 T593 Y594	T588-E590 PolarHBondContact O-N 3.16Å; T588-E590 VanDerWaalsContact O-N 3.1Å; E590-T593 PolarHBondContact O-N 2.94Å; E590-Y594 WeakPolarHBondContact O-CB 3.46Å; E590-Y594 PolarHBondContact O-N 3.2Å
591	Q	35.1	Very low	33.4	Very low	108 Å²	108	95.3 Å²	95.3	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-66	-37.3	176.1	-72.1	168.4	3.9	0	0	112.3	T588 L595	T588-Q591 PolarHBondContact O-N 3.05Å; T588-Q591 WeakPolarHBondContact OG1-CB 3.28Å; T588-Q591 VanDerWaalsContact OG1-CG 3.24Å; T588-Q591 WeakPolarHBondContact OG1-CG 3.38Å; T588-Q591 PolarHBondContact OG1-N 3.4Å; Q591-L595 VanDerWaalsContact O-CB 3.29Å; Q591-L595 WeakPolarHBondContact O-CB 3.34Å; Q591-L595 PolarHBondContact O-N 3.06Å
592	Q	36.8	Very low	33.7	Very low	40 Å²	40	91.6 Å²	91.6	19%	0.187	46%	0.462	C	S	.	.	H	α-helix	trans	-62.4	-50.7	171	-65.9	-172.2	40.1	0	0	110.2	L587 T588 Y594 L595 I596 L627	L587-Q592 HydrophobicContact CB-CG 3.51Å; L587-Q592 HydrophobicContact CD1-CG 4.38Å; L587-Q592 PolarHBondContact O-NE2 3.45Å; T588-Q592 WeakPolarHBondContact O-CG 3.34Å; T588-Q592 PolarHBondContact O-N 3.18Å; Q592-Y594 VanDerWaalsContact C-N 3.31Å; Q592-Y594 PolarHBondContact O-N 3.25Å; Q592-L595 PolarHBondContact O-N 3.02Å; Q592-I596 WeakPolarHBondContact O-CB 3.47Å; Q592-I596 WeakPolarHBondContact O-CD1 3.49Å; Q592-I596 WeakPolarHBondContact O-CG1 3.3Å; Q592-I596 PolarHBondContact O-N 2.9Å; Q592-L627 HydrophobicContact CB-CD1 4.48Å
593	T	34.8	Very low	33.9	Very low	12 Å²	12	83.7 Å²	83.7	7%	0.074	43%	0.434	C	S	.	.	H	α-helix	trans	-57.6	-43.5	177.7	-56.1	0	0	0	0	111.6	L589 E590 I596 S597 K634	L589-T593 WeakPolarHBondContact O-CB 3.14Å; L589-T593 PolarHBondContact O-N 2.99Å; L589-T593 PolarHBondContact O-OG1 2.82Å; E590-T593 PolarHBondContact O-N 2.94Å; T593-I596 PolarHBondContact O-N 3.04Å; T593-S597 VanDerWaalsContact O-CB 3.28Å; T593-S597 WeakPolarHBondContact O-CB 3.48Å; T593-S597 PolarHBondContact O-N 3.09Å; T593-S597 PolarHBondContact O-OG 2.89Å; T593-K634 HydrophobicContact CG2-CD 4.22Å
594	Y	35.7	Very low	34.2	Very low	169 Å²	169	84.6 Å²	84.6	66%	0.663	43%	0.433	S	S	*	.	H	α-helix	trans	-66.4	-44.9	179.9	-144.3	-76.2	0	0	0	111.9	E590 Q592 I596 S597 S598	E590-Y594 WeakPolarHBondContact O-CB 3.46Å; E590-Y594 PolarHBondContact O-N 3.2Å; Q592-Y594 VanDerWaalsContact C-N 3.31Å; Q592-Y594 PolarHBondContact O-N 3.25Å; Y594-I596 PolarHBondContact O-N 2.92Å; Y594-S597 PolarHBondContact O-N 3.36Å; Y594-S598 PolarHBondContact O-N 3.43Å; Y594-S598 PolarHBondContact O-OG 3.25Å; Y594-S598 VanDerWaalsContact O-OG 3.13Å
595	L	36.8	Very low	34.2	Very low	90 Å²	90	87 Å²	87	47%	0.471	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-45.2	176.4	-176.8	67.8	0	0	0	111.5	L587 Q591 Q592 S598 M599	L587-L595 HydrophobicContact CD1-CD2 4.45Å; Q591-L595 VanDerWaalsContact O-CB 3.29Å; Q591-L595 WeakPolarHBondContact O-CB 3.34Å; Q591-L595 PolarHBondContact O-N 3.06Å; Q592-L595 PolarHBondContact O-N 3.02Å; L595-S598 PolarHBondContact O-N 2.89Å; L595-M599 HydrophobicContact CD1-CE 4.18Å; L595-M599 WeakPolarHBondContact O-CB 3.47Å; L595-M599 WeakPolarHBondContact O-CG 3.27Å; L595-M599 PolarHBondContact O-N 2.8Å
596	I	36.3	Very low	34.2	Very low	27 Å²	27	86.3 Å²	86.3	14%	0.138	43%	0.427	C	S	.	.	H	α-helix	trans	-66	-42.8	178.1	-65.6	169.6	0	0	0	110.2	Q592 T593 Y594 M599 A600 F616 I620 L627 F631	Q592-I596 WeakPolarHBondContact O-CB 3.47Å; Q592-I596 WeakPolarHBondContact O-CD1 3.49Å; Q592-I596 WeakPolarHBondContact O-CG1 3.3Å; Q592-I596 PolarHBondContact O-N 2.9Å; T593-I596 PolarHBondContact O-N 3.04Å; Y594-I596 PolarHBondContact O-N 2.92Å; I596-M599 CarbonylContact O-C 3.49Å; I596-M599 PolarHBondContact O-N 2.9Å; I596-A600 WeakPolarHBondContact O-CB 3.27Å; I596-A600 PolarHBondContact O-N 3.1Å; I596-F616 HydrophobicContact CB-CZ 4.42Å; I596-F616 HydrophobicContact CG1-CZ 4.18Å; I596-F616 HydrophobicContact CG2-CE1 3.8Å; I596-F616 HydrophobicContact CG2-CZ 3.83Å; I596-I620 HydrophobicContact CG2-CD1 4.41Å; I596-L627 HydrophobicContact CD1-CD1 4.46Å; I596-F631 HydrophobicContact CB-CE2 4.39Å; I596-F631 HydrophobicContact CG2-CD2 3.7Å; I596-F631 HydrophobicContact CG2-CE2 3.43Å; I596-F631 VanDerWaalsContact CG2-CE2 3.43Å; I596-F631 HydrophobicContact CG2-CZ 4.02Å
597	S	34.6	Very low	34.3	Very low	24 Å²	24	90.7 Å²	90.7	17%	0.168	45%	0.445	C	S	.	.	H	α-helix	trans	-66	-39.2	176.1	-69.6	0	0	0	0	113.3	T593 Y594 A600 Q601	T593-S597 VanDerWaalsContact O-CB 3.28Å; T593-S597 WeakPolarHBondContact O-CB 3.48Å; T593-S597 PolarHBondContact O-N 3.09Å; T593-S597 PolarHBondContact O-OG 2.89Å; Y594-S597 PolarHBondContact O-N 3.36Å; S597-A600 WeakPolarHBondContact O-CB 3.42Å; S597-A600 PolarHBondContact O-N 2.89Å; S597-Q601 PolarHBondContact O-N 3.04Å
598	S	34.7	Very low	34.5	Very low	48 Å²	48	93.4 Å²	93.4	34%	0.336	46%	0.455	S	S	.	.	H	α-helix	trans	-65.5	-39.4	172.9	-62.3	0	0	0	0	111.9	Y594 L595 A600 L602	Y594-S598 PolarHBondContact O-N 3.43Å; Y594-S598 PolarHBondContact O-OG 3.25Å; Y594-S598 VanDerWaalsContact O-OG 3.13Å; L595-S598 PolarHBondContact O-N 2.89Å; S598-A600 VanDerWaalsContact C-N 3.33Å; S598-L602 WeakPolarHBondContact O-CB 3.45Å; S598-L602 WeakPolarHBondContact O-CG 3.41Å; S598-L602 PolarHBondContact O-N 3.39Å
599	M	37.1	Very low	34.8	Very low	104 Å²	104	94.4 Å²	94.4	51%	0.512	45%	0.451	S	S	.	.	H	α-helix	trans	-68.5	-31.1	172.9	-72.4	-172.8	175.1	0	0	112.7	L595 I596 L602 S603	L595-M599 HydrophobicContact CD1-CE 4.18Å; L595-M599 WeakPolarHBondContact O-CB 3.47Å; L595-M599 WeakPolarHBondContact O-CG 3.27Å; L595-M599 PolarHBondContact O-N 2.8Å; I596-M599 CarbonylContact O-C 3.49Å; I596-M599 PolarHBondContact O-N 2.9Å; M599-L602 CarbonylContact O-C 3.6Å; M599-L602 PolarHBondContact O-N 3.14Å; M599-S603 PolarHBondContact O-N 3.49Å
600	A	34	Very low	34.9	Very low	9 Å²	9	95.4 Å²	95.4	7%	0.074	45%	0.447	C	S	.	.	H	α-helix	trans	-69.3	-45.3	173.8	0	0	0	0	0	111.8	I596 S597 S598 L602 S603 I604 F631	I596-A600 WeakPolarHBondContact O-CB 3.27Å; I596-A600 PolarHBondContact O-N 3.1Å; S597-A600 WeakPolarHBondContact O-CB 3.42Å; S597-A600 PolarHBondContact O-N 2.89Å; S598-A600 VanDerWaalsContact C-N 3.33Å; A600-L602 VanDerWaalsContact C-N 3.29Å; A600-L602 PolarHBondContact O-N 3.31Å; A600-S603 CarbonylContact O-C 3.43Å; A600-S603 WeakPolarHBondContact O-CA 3.23Å; A600-S603 WeakPolarHBondContact O-CB 3.37Å; A600-S603 PolarHBondContact O-N 3.07Å; A600-S603 PolarHBondContact O-OG 2.71Å; A600-I604 WeakPolarHBondContact O-CG1 3.48Å; A600-I604 PolarHBondContact O-N 3.05Å; A600-F631 HydrophobicContact CB-CE2 4.22Å; A600-F631 HydrophobicContact CB-CZ 3.79Å
601	Q	33.5	Very low	35.1	Very low	133 Å²	133	97.4 Å²	97.4	62%	0.621	45%	0.449	S	S	*	.	H	α-helix	trans	-60.7	-37.7	172.9	-74.7	-177.9	-27.9	0	0	112.2	S597 S603 I604	S597-Q601 PolarHBondContact O-N 3.04Å; Q601-S603 PolarHBondContact O-N 3.26Å; Q601-I604 HydrophobicContact CG-CD1 4.36Å; Q601-I604 PolarHBondContact O-N 3.22Å
602	L	31.8	Very low	35.3	Very low	117 Å²	117	96.8 Å²	96.8	61%	0.613	45%	0.447	S	S	*	.	H	α-helix	trans	-67	-7.4	169	-74.9	167.3	0	0	0	114.4	S598 M599 A600 R609	S598-L602 WeakPolarHBondContact O-CB 3.45Å; S598-L602 WeakPolarHBondContact O-CG 3.41Å; S598-L602 PolarHBondContact O-N 3.39Å; M599-L602 CarbonylContact O-C 3.6Å; M599-L602 PolarHBondContact O-N 3.14Å; A600-L602 VanDerWaalsContact C-N 3.29Å; A600-L602 PolarHBondContact O-N 3.31Å; L602-R609 PolarHBondContact O-NH1 3.49Å
603	S	33	Very low	35.5	Very low	22 Å²	22	97.9 Å²	97.9	15%	0.154	45%	0.453	C	S	.	.	H	α-helix	trans	-100.2	-30.1	172.1	79.3	0	0	0	0	113.3	M599 A600 Q601 F605 H606	M599-S603 PolarHBondContact O-N 3.49Å; A600-S603 CarbonylContact O-C 3.43Å; A600-S603 WeakPolarHBondContact O-CA 3.23Å; A600-S603 WeakPolarHBondContact O-CB 3.37Å; A600-S603 PolarHBondContact O-N 3.07Å; A600-S603 PolarHBondContact O-OG 2.71Å; Q601-S603 PolarHBondContact O-N 3.26Å; S603-F605 PolarHBondContact O-N 3.25Å; S603-H606 PolarHBondContact O-N 3.11Å; S603-H606 VanDerWaalsContact O-N 3.17Å
604	I	33.6	Very low	35.6	Very low	87 Å²	87	102.5 Å²	102.5	45%	0.446	47%	0.469	S	S	.	.	H	α-helix	trans	-56.7	-39.7	174.7	-62.8	173	0	0	0	111	A600 Q601 H606 M637	A600-I604 WeakPolarHBondContact O-CG1 3.48Å; A600-I604 PolarHBondContact O-N 3.05Å; Q601-I604 HydrophobicContact CG-CD1 4.36Å; Q601-I604 PolarHBondContact O-N 3.22Å; I604-H606 PolarHBondContact O-N 2.88Å; I604-M637 HydrophobicContact CD1-CE 3.6Å; I604-M637 HydrophobicContact CD1-CG 4.46Å; I604-M637 HydrophobicContact CD1-SD 3.76Å; I604-M637 HydrophobicContact CG1-CE 3.56Å; I604-M637 HydrophobicContact CG1-SD 4.18Å
605	F	32.9	Very low	35.8	Very low	176 Å²	176	98.6 Å²	98.6	77%	0.772	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.1	-177.9	-110.5	-92.1	0	0	0	115.4	S603	S603-F605 PolarHBondContact O-N 3.25Å
606	H	34.8	Very low	36.1	Very low	125 Å²	125	97.8 Å²	97.8	58%	0.579	46%	0.456	S	S	*	.			trans	-140.3	93.9	-176.6	-75.3	-31.2	0	0	0	113.3	S603 I604 Q608 R609	S603-H606 PolarHBondContact O-N 3.11Å; S603-H606 VanDerWaalsContact O-N 3.17Å; I604-H606 PolarHBondContact O-N 2.88Å; H606-Q608 PolarHBondContact O-N 3.31Å; H606-R609 PolarHBondContact O-N 2.86Å
607	F	32.9	Very low	36.3	Very low	204 Å²	204	98.9 Å²	98.9	90%	0.895	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-47	-23.5	-179.1	-84.4	-96.3	0	0	0	117	R609	F607-R609 PolarHBondContact O-N 3.38Å; F607-R609 VanDerWaalsContact O-N 3.1Å
608	Q	36.6	Very low	36.5	Very low	150 Å²	150	104 Å²	104	70%	0.701	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-68.7	-5.8	179.7	-69.3	-176.9	-36.8	0	0	114.1	H606 Y610	H606-Q608 PolarHBondContact O-N 3.31Å; Q608-Y610 PolarHBondContact O-N 2.55Å
609	R	41.1	Very low	36.7	Very low	95 Å²	95	105.8 Å²	105.8	36%	0.358	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-81.3	0.9	-173.4	-74	-163.6	149.4	156.5	1.4	117.1	L602 H606 F607 R611 Q612 I613	L602-R609 PolarHBondContact O-NH1 3.49Å; H606-R609 PolarHBondContact O-N 2.86Å; F607-R609 PolarHBondContact O-N 3.38Å; F607-R609 VanDerWaalsContact O-N 3.1Å; R609-R611 VanDerWaalsContact C-N 3.28Å; R609-R611 PolarHBondContact O-N 2.72Å; R609-R611 VanDerWaalsContact O-N 3.11Å; R609-Q612 HydrophobicContact CB-CB 4.48Å; R609-Q612 CarbonylContact O-C 3.08Å; R609-Q612 WeakPolarHBondContact O-CA 3.48Å; R609-Q612 PolarHBondContact O-N 2.86Å; R609-I613 HydrophobicContact CB-CD1 4.07Å; R609-I613 HydrophobicContact CB-CG1 4.27Å; R609-I613 WeakPolarHBondContact O-CG1 3.11Å; R609-I613 PolarHBondContact O-N 2.78Å
610	Y	35.3	Very low	36.8	Very low	136 Å²	136	101.6 Å²	101.6	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-49.2	-44	-178.7	-178.6	-99.4	0	0	0	113.8	Q608 R614	Q608-Y610 PolarHBondContact O-N 2.55Å; Y610-R614 WeakPolarHBondContact O-CB 3.5Å; Y610-R614 PolarHBondContact O-N 2.96Å
611	R	36.5	Very low	37	Very low	169 Å²	169	108.7 Å²	108.7	64%	0.638	50%	0.498	S	S	*	.	H	α-helix	trans	-66.3	-39.1	175.7	-74.7	-177.8	172.8	177.7	-2.3	113.3	R609 R614 V615	R609-R611 VanDerWaalsContact C-N 3.28Å; R609-R611 PolarHBondContact O-N 2.72Å; R609-R611 VanDerWaalsContact O-N 3.11Å; R611-R614 WeakPolarHBondContact O-CB 3.4Å; R611-R614 PolarHBondContact O-N 3.45Å; R611-V615 WeakPolarHBondContact O-CG2 3.28Å; R611-V615 PolarHBondContact O-N 2.93Å
612	Q	39.2	Very low	37	Very low	96 Å²	96	111.9 Å²	111.9	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-69	-41.7	178.2	-65.7	-179.2	-8.2	0	0	110.8	R609 R614 V615 F616	R609-Q612 HydrophobicContact CB-CB 4.48Å; R609-Q612 CarbonylContact O-C 3.08Å; R609-Q612 WeakPolarHBondContact O-CA 3.48Å; R609-Q612 PolarHBondContact O-N 2.86Å; Q612-R614 VanDerWaalsContact C-N 3.34Å; Q612-R614 PolarHBondContact O-N 3.23Å; Q612-V615 PolarHBondContact O-N 3.43Å; Q612-F616 VanDerWaalsContact O-CB 3.27Å; Q612-F616 WeakPolarHBondContact O-CB 3.27Å; Q612-F616 PolarHBondContact O-N 3.27Å
613	I	39.3	Very low	37.1	Very low	63 Å²	63	114.4 Å²	114.4	32%	0.323	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-42.1	171.4	-65.9	164.3	0	0	0	110.4	R609 F616 L617	R609-I613 HydrophobicContact CB-CD1 4.07Å; R609-I613 HydrophobicContact CB-CG1 4.27Å; R609-I613 WeakPolarHBondContact O-CG1 3.11Å; R609-I613 PolarHBondContact O-N 2.78Å; I613-F616 PolarHBondContact O-N 3.24Å; I613-L617 HydrophobicContact CG2-CD1 3.78Å; I613-L617 HydrophobicContact CG2-CG 4.23Å; I613-L617 WeakPolarHBondContact O-CB 3.22Å; I613-L617 WeakPolarHBondContact O-CG 3.32Å; I613-L617 PolarHBondContact O-N 2.72Å
614	R	38.7	Very low	37.4	Very low	109 Å²	109	116 Å²	116	41%	0.411	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-47.5	175.4	-130.9	-176.5	-159.3	-145.8	7.2	112.5	Y610 R611 Q612 M618	Y610-R614 WeakPolarHBondContact O-CB 3.5Å; Y610-R614 PolarHBondContact O-N 2.96Å; R611-R614 WeakPolarHBondContact O-CB 3.4Å; R611-R614 PolarHBondContact O-N 3.45Å; Q612-R614 VanDerWaalsContact C-N 3.34Å; Q612-R614 PolarHBondContact O-N 3.23Å; R614-M618 WeakPolarHBondContact O-CB 3.5Å; R614-M618 VanDerWaalsContact O-CG 3.29Å; R614-M618 WeakPolarHBondContact O-CG 3.1Å; R614-M618 PolarHBondContact O-N 2.77Å
615	V	38.3	Very low	37.4	Very low	86 Å²	86	115 Å²	115	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-41.6	177.1	171.5	0	0	0	0	110.8	R611 Q612 M618 I619	R611-V615 WeakPolarHBondContact O-CG2 3.28Å; R611-V615 PolarHBondContact O-N 2.93Å; Q612-V615 PolarHBondContact O-N 3.43Å; V615-M618 WeakPolarHBondContact O-CB 3.25Å; V615-M618 PolarHBondContact O-N 2.73Å; V615-I619 HydrophobicContact CG1-CD1 3.97Å; V615-I619 VanDerWaalsContact O-CG1 3.32Å; V615-I619 WeakPolarHBondContact O-CG1 3.4Å; V615-I619 PolarHBondContact O-N 3.4Å
616	F	42.9	Very low	37.6	Very low	74 Å²	74	114.3 Å²	114.3	33%	0.325	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-45.3	177.9	-171.6	-115.9	0	0	0	112.6	I596 Q612 I613 M618 I619 I620	I596-F616 HydrophobicContact CB-CZ 4.42Å; I596-F616 HydrophobicContact CG1-CZ 4.18Å; I596-F616 HydrophobicContact CG2-CE1 3.8Å; I596-F616 HydrophobicContact CG2-CZ 3.83Å; Q612-F616 VanDerWaalsContact O-CB 3.27Å; Q612-F616 WeakPolarHBondContact O-CB 3.27Å; Q612-F616 PolarHBondContact O-N 3.27Å; I613-F616 PolarHBondContact O-N 3.24Å; F616-M618 VanDerWaalsContact C-N 3.33Å; F616-M618 PolarHBondContact O-N 3.05Å; F616-I619 WeakPolarHBondContact O-CB 3.44Å; F616-I619 PolarHBondContact O-N 3.07Å; F616-I620 HydrophobicContact CD1-CD1 3.85Å; F616-I620 HydrophobicContact CE1-CD1 3.68Å; F616-I620 HydrophobicContact CG-CD1 4.41Å; F616-I620 HydrophobicContact CZ-CD1 4.09Å; F616-I620 WeakPolarHBondContact O-CG1 3.22Å; F616-I620 PolarHBondContact O-N 3.02Å
617	L	41	Very low	37.8	Very low	50 Å²	50	108.9 Å²	108.9	26%	0.262	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-33.8	173.4	-71.5	172.7	0	0	0	112.3	I613 K621 L628	I613-L617 HydrophobicContact CG2-CD1 3.78Å; I613-L617 HydrophobicContact CG2-CG 4.23Å; I613-L617 WeakPolarHBondContact O-CB 3.22Å; I613-L617 WeakPolarHBondContact O-CG 3.32Å; I613-L617 PolarHBondContact O-N 2.72Å; L617-K621 WeakPolarHBondContact O-CB 3.13Å; L617-K621 PolarHBondContact O-N 3.11Å; L617-L628 HydrophobicContact CD2-CD1 4.16Å
618	M	38.9	Very low	38.1	Very low	130 Å²	130	101.7 Å²	101.7	64%	0.64	46%	0.46	S	S	*	.	H	α-helix	trans	-66.1	-37.8	171	-77.6	176.9	64.3	0	0	112.3	R614 V615 F616 R622	R614-M618 WeakPolarHBondContact O-CB 3.5Å; R614-M618 VanDerWaalsContact O-CG 3.29Å; R614-M618 WeakPolarHBondContact O-CG 3.1Å; R614-M618 PolarHBondContact O-N 2.77Å; V615-M618 WeakPolarHBondContact O-CB 3.25Å; V615-M618 PolarHBondContact O-N 2.73Å; F616-M618 VanDerWaalsContact C-N 3.33Å; F616-M618 PolarHBondContact O-N 3.05Å; M618-R622 WeakPolarHBondContact O-CB 3.44Å; M618-R622 PolarHBondContact O-N 3Å; M618-R622 VanDerWaalsContact O-N 3.07Å
619	I	39.1	Very low	38.2	Very low	87 Å²	87	98.5 Å²	98.5	45%	0.446	45%	0.452	S	S	.	.	H	α-helix	trans	-65.9	-48.8	174.4	-70.5	163.3	0	0	0	110	V615 F616 R622 Y623	V615-I619 HydrophobicContact CG1-CD1 3.97Å; V615-I619 VanDerWaalsContact O-CG1 3.32Å; V615-I619 WeakPolarHBondContact O-CG1 3.4Å; V615-I619 PolarHBondContact O-N 3.4Å; F616-I619 WeakPolarHBondContact O-CB 3.44Å; F616-I619 PolarHBondContact O-N 3.07Å; I619-R622 PolarHBondContact O-N 3.02Å; I619-Y623 HydrophobicContact CG2-CD2 4.14Å; I619-Y623 WeakPolarHBondContact O-CB 3.15Å; I619-Y623 WeakPolarHBondContact O-CD2 3.28Å; I619-Y623 PolarHBondContact O-N 2.72Å
620	I	39.2	Very low	38.1	Very low	15 Å²	15	96.3 Å²	96.3	8%	0.077	45%	0.451	C	S	.	.	H	α-helix	trans	-60.2	-51.2	177.6	-67.2	167.5	0	0	0	110.5	I596 F616 R622 Y623 V624 L628	I596-I620 HydrophobicContact CG2-CD1 4.41Å; F616-I620 HydrophobicContact CD1-CD1 3.85Å; F616-I620 HydrophobicContact CE1-CD1 3.68Å; F616-I620 HydrophobicContact CG-CD1 4.41Å; F616-I620 HydrophobicContact CZ-CD1 4.09Å; F616-I620 WeakPolarHBondContact O-CG1 3.22Å; F616-I620 PolarHBondContact O-N 3.02Å; I620-R622 PolarHBondContact O-N 3.44Å; I620-Y623 PolarHBondContact O-N 3.43Å; I620-V624 CarbonylContact O-C 3.58Å; I620-V624 WeakPolarHBondContact O-CA 3.3Å; I620-V624 PolarHBondContact O-N 3.41Å; I620-L628 HydrophobicContact CG2-CD1 4.29Å
621	K	37.8	Very low	38.1	Very low	159 Å²	159	91 Å²	91	69%	0.691	43%	0.43	S	S	*	.	H	α-helix	trans	-61.7	-25.4	179.3	-175.6	172.6	179.7	176.8	0	113.7	L617	L617-K621 WeakPolarHBondContact O-CB 3.13Å; L617-K621 PolarHBondContact O-N 3.11Å
622	R	34.7	Very low	38.1	Very low	200 Å²	200	85.6 Å²	85.6	76%	0.755	41%	0.413	S	S	*	.	H	α-helix	trans	-98.5	-22.5	-176.6	-167.8	170.1	-173.1	124.3	3.7	114.4	M618 I619 I620	M618-R622 WeakPolarHBondContact O-CB 3.44Å; M618-R622 PolarHBondContact O-N 3Å; M618-R622 VanDerWaalsContact O-N 3.07Å; I619-R622 PolarHBondContact O-N 3.02Å; I620-R622 PolarHBondContact O-N 3.44Å
623	Y	34.2	Very low	38	Very low	169 Å²	169	88.8 Å²	88.8	66%	0.663	43%	0.428	S	S	*	.	H	α-helix	trans	-125.5	-21.4	-174.6	-61.7	-75.1	0	0	0	114.8	I619 I620	I619-Y623 HydrophobicContact CG2-CD2 4.14Å; I619-Y623 WeakPolarHBondContact O-CB 3.15Å; I619-Y623 WeakPolarHBondContact O-CD2 3.28Å; I619-Y623 PolarHBondContact O-N 2.72Å; I620-Y623 PolarHBondContact O-N 3.43Å
624	V	37.6	Very low	37.7	Very low	56 Å²	56	92.2 Å²	92.2	34%	0.339	44%	0.441	S	S	.	.			trans	-146.5	58.4	176.4	-154.1	0	0	0	0	111.7	I620 E626 L627	I620-V624 CarbonylContact O-C 3.58Å; I620-V624 WeakPolarHBondContact O-CA 3.3Å; I620-V624 PolarHBondContact O-N 3.41Å; V624-E626 VanDerWaalsContact C-N 3.27Å; V624-E626 PolarHBondContact O-N 3.08Å; V624-L627 HydrophobicContact CB-CD1 4.23Å; V624-L627 HydrophobicContact CG1-CB 4.41Å; V624-L627 HydrophobicContact CG1-CD1 3.57Å; V624-L627 HydrophobicContact CG1-CG 3.82Å; V624-L627 PolarHBondContact O-N 3.33Å
625	P	35.3	Very low	37.6	Very low	66 Å²	66	88.6 Å²	88.6	43%	0.429	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-63.1	-29.6	-170.7	25.8	-35	0	0	0	113.9	L627 L628	P625-L627 PolarHBondContact O-N 2.78Å; P625-L628 WeakPolarHBondContact O-CB 3.38Å; P625-L628 PolarHBondContact O-N 2.9Å
626	E	36.6	Very low	37.4	Very low	162 Å²	162	95.2 Å²	95.2	76%	0.757	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24.1	-179.3	-65.6	132.7	-125.5	0	0	114.2	V624 L628 P629	V624-E626 VanDerWaalsContact C-N 3.27Å; V624-E626 PolarHBondContact O-N 3.08Å; E626-L628 VanDerWaalsContact C-N 3.31Å; E626-L628 PolarHBondContact O-N 3.38Å; E626-P629 WeakPolarHBondContact O-CD 3.38Å
627	L	38.6	Very low	37.1	Very low	11 Å²	11	93.7 Å²	93.7	6%	0.058	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-74.5	-20	178.9	-80.3	177.4	0	0	0	113.6	L589 Q592 I596 V624 P625 S630 F631	L589-L627 HydrophobicContact CD1-CD2 3.48Å; L589-L627 VanDerWaalsContact CD1-CD2 3.48Å; L589-L627 HydrophobicContact CD1-CG 4.37Å; L589-L627 HydrophobicContact CD2-CD2 4.46Å; L589-L627 HydrophobicContact CG-CD2 3.7Å; Q592-L627 HydrophobicContact CB-CD1 4.48Å; I596-L627 HydrophobicContact CD1-CD1 4.46Å; V624-L627 HydrophobicContact CB-CD1 4.23Å; V624-L627 HydrophobicContact CG1-CB 4.41Å; V624-L627 HydrophobicContact CG1-CD1 3.57Å; V624-L627 HydrophobicContact CG1-CG 3.82Å; V624-L627 PolarHBondContact O-N 3.33Å; P625-L627 PolarHBondContact O-N 2.78Å; L627-S630 PolarHBondContact O-N 3.24Å; L627-F631 PolarHBondContact O-N 3.29Å
628	L	39.6	Very low	36.9	Very low	53 Å²	53	97.1 Å²	97.1	28%	0.277	46%	0.459	S	S	.	.	H	α-helix	trans	-59.9	-43.2	-168.7	-164.3	67.1	0	0	0	113.4	L617 I620 P625 E626 F631 M632	L617-L628 HydrophobicContact CD2-CD1 4.16Å; I620-L628 HydrophobicContact CG2-CD1 4.29Å; P625-L628 WeakPolarHBondContact O-CB 3.38Å; P625-L628 PolarHBondContact O-N 2.9Å; E626-L628 VanDerWaalsContact C-N 3.31Å; E626-L628 PolarHBondContact O-N 3.38Å; L628-F631 PolarHBondContact O-N 3.44Å; L628-M632 WeakPolarHBondContact O-CG 3.28Å; L628-M632 PolarHBondContact O-N 3.17Å; L628-M632 VanDerWaalsContact O-N 3.14Å
629	P	37.6	Very low	36.8	Very low	83 Å²	83	97.2 Å²	97.2	54%	0.539	46%	0.463	S	S	.	.	H	α-helix	trans	-66.2	-40.6	178.1	-20.5	34.3	0	0	0	113.5	E626 F631 M632 Q633	E626-P629 WeakPolarHBondContact O-CD 3.38Å; P629-F631 VanDerWaalsContact C-N 3.32Å; P629-F631 PolarHBondContact O-N 3.48Å; P629-M632 PolarHBondContact O-N 3.16Å; P629-Q633 PolarHBondContact O-N 3.28Å
630	S	39.1	Very low	36.6	Very low	48 Å²	48	94.9 Å²	94.9	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-36.4	177.5	-76.5	0	0	0	0	112.2	L627 K634	L627-S630 PolarHBondContact O-N 3.24Å; S630-K634 WeakPolarHBondContact O-CB 3.45Å; S630-K634 PolarHBondContact O-N 2.66Å; S630-K634 VanDerWaalsContact O-N 3.07Å
631	F	36.3	Very low	36.4	Very low	24 Å²	24	96 Å²	96	11%	0.105	46%	0.464	C	S	.	.	H	α-helix	trans	-66.9	-40.3	176.2	-178	-107.9	0	0	0	112	I596 A600 L627 L628 P629 T635	I596-F631 HydrophobicContact CB-CE2 4.39Å; I596-F631 HydrophobicContact CG2-CD2 3.7Å; I596-F631 HydrophobicContact CG2-CE2 3.43Å; I596-F631 VanDerWaalsContact CG2-CE2 3.43Å; I596-F631 HydrophobicContact CG2-CZ 4.02Å; A600-F631 HydrophobicContact CB-CE2 4.22Å; A600-F631 HydrophobicContact CB-CZ 3.79Å; L627-F631 PolarHBondContact O-N 3.29Å; L628-F631 PolarHBondContact O-N 3.44Å; P629-F631 VanDerWaalsContact C-N 3.32Å; P629-F631 PolarHBondContact O-N 3.48Å; F631-T635 HydrophobicContact CD2-CG2 3.97Å; F631-T635 HydrophobicContact CE2-CG2 3.61Å; F631-T635 HydrophobicContact CZ-CG2 3.93Å; F631-T635 VanDerWaalsContact O-CG2 3.28Å; F631-T635 WeakPolarHBondContact O-CG2 3.44Å; F631-T635 PolarHBondContact O-N 2.95Å; F631-T635 PolarHBondContact O-OG1 3.27Å
632	M	36.5	Very low	36.4	Very low	56 Å²	56	93.8 Å²	93.8	28%	0.276	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-47.1	174.7	-63.7	-78.5	-83.3	0	0	111.5	L628 P629 T635 V640 A641 I644	L628-M632 WeakPolarHBondContact O-CG 3.28Å; L628-M632 PolarHBondContact O-N 3.17Å; L628-M632 VanDerWaalsContact O-N 3.14Å; P629-M632 PolarHBondContact O-N 3.16Å; M632-T635 PolarHBondContact O-OG1 2.99Å; M632-V640 HydrophobicContact SD-CG1 3.95Å; M632-A641 HydrophobicContact CE-CB 4.48Å; M632-I644 HydrophobicContact CE-CB 4.06Å; M632-I644 HydrophobicContact CE-CD1 3.68Å; M632-I644 HydrophobicContact CE-CG1 4.44Å; M632-I644 HydrophobicContact CE-CG2 4.11Å; M632-I644 HydrophobicContact SD-CD1 3.56Å; M632-I644 VanDerWaalsContact SD-CD1 3.56Å
633	Q	36.4	Very low	36.5	Very low	163 Å²	163	86.4 Å²	86.4	76%	0.762	44%	0.439	S	S	*	.	H	α-helix	trans	-66.9	-41.7	-179.3	-76.2	-175.1	-24.9	0	0	113.9	P629	P629-Q633 PolarHBondContact O-N 3.28Å
634	K	33.9	Very low	36.6	Very low	135 Å²	135	79.8 Å²	79.8	59%	0.587	42%	0.415	S	S	*	.	H	α-helix	trans	-81	-15.2	-172.7	-78.9	-170.1	172.2	-174.8	0	115.1	T593 S630	T593-K634 HydrophobicContact CG2-CD 4.22Å; S630-K634 WeakPolarHBondContact O-CB 3.45Å; S630-K634 PolarHBondContact O-N 2.66Å; S630-K634 VanDerWaalsContact O-N 3.07Å
635	T	36.1	Very low	36.6	Very low	33 Å²	33	81.9 Å²	81.9	20%	0.202	42%	0.421	C	S	.	.	H	α-helix	trans	-89.6	-15.8	-173.8	48.3	0	0	0	0	114.8	F631 M632 M637	F631-T635 HydrophobicContact CD2-CG2 3.97Å; F631-T635 HydrophobicContact CE2-CG2 3.61Å; F631-T635 HydrophobicContact CZ-CG2 3.93Å; F631-T635 VanDerWaalsContact O-CG2 3.28Å; F631-T635 WeakPolarHBondContact O-CG2 3.44Å; F631-T635 PolarHBondContact O-N 2.95Å; F631-T635 PolarHBondContact O-OG1 3.27Å; M632-T635 PolarHBondContact O-OG1 2.99Å; T635-M637 PolarHBondContact O-N 2.89Å
636	R	34.9	Very low	36.6	Very low	225 Å²	225	83.4 Å²	83.4	85%	0.849	43%	0.426	S	S	*	.			trans	48.6	35	-171.2	-66.2	-170.7	175.8	-168.4	-1.5	113.1	D638	R636-D638 PolarHBondContact O-N 3.12Å
637	M	36.6	Very low	36.7	Very low	42 Å²	42	80.7 Å²	80.7	21%	0.207	42%	0.415	C	S	.	.			trans	-95	78.7	175.7	-69.8	-169.4	78.8	0	0	109.4	I604 T635 D639 V640 A641	I604-M637 HydrophobicContact CD1-CE 3.6Å; I604-M637 HydrophobicContact CD1-CG 4.46Å; I604-M637 HydrophobicContact CD1-SD 3.76Å; I604-M637 HydrophobicContact CG1-CE 3.56Å; I604-M637 HydrophobicContact CG1-SD 4.18Å; T635-M637 PolarHBondContact O-N 2.89Å; M637-D639 PolarHBondContact O-N 3.37Å; M637-V640 HydrophobicContact CB-CB 3.83Å; M637-V640 HydrophobicContact CB-CG2 3.85Å; M637-V640 HydrophobicContact CE-CG2 3.6Å; M637-V640 WeakPolarHBondContact O-CA 3.48Å; M637-V640 WeakPolarHBondContact O-CB 3.47Å; M637-V640 PolarHBondContact O-N 3.13Å; M637-V640 HydrophobicContact SD-CG2 3.99Å; M637-A641 PolarHBondContact O-N 3.16Å
638	D	36.7	Very low	36.5	Very low	122 Å²	122	86.8 Å²	86.8	65%	0.652	44%	0.443	S	S	*	.	H	α-helix	trans	-61.3	-27.4	176.3	-58.1	-40.7	0	0	0	111	R636 V640 A641 M642	R636-D638 PolarHBondContact O-N 3.12Å; D638-V640 VanDerWaalsContact C-N 3.29Å; D638-V640 PolarHBondContact O-N 3.26Å; D638-A641 WeakPolarHBondContact O-CB 3.38Å; D638-A641 PolarHBondContact O-N 2.93Å; D638-M642 WeakPolarHBondContact O-CB 3.5Å; D638-M642 WeakPolarHBondContact O-CG 3.29Å; D638-M642 PolarHBondContact O-N 2.78Å
639	D	36.2	Very low	36.6	Very low	132 Å²	132	89.2 Å²	89.2	71%	0.706	46%	0.457	S	S	*	.	H	α-helix	trans	-62.4	-29.3	168.7	-60.1	-46.6	0	0	0	113.9	M637 A643	M637-D639 PolarHBondContact O-N 3.37Å; D639-A643 VanDerWaalsContact O-CB 3.23Å; D639-A643 WeakPolarHBondContact O-CB 3.1Å; D639-A643 PolarHBondContact O-N 2.81Å
640	V	35.7	Very low	36.6	Very low	39 Å²	39	87.3 Å²	87.3	24%	0.236	45%	0.453	C	S	.	.	H	α-helix	trans	-87.1	-30.5	177.2	172.7	0	0	0	0	110.8	M632 M637 D638 I644	M632-V640 HydrophobicContact SD-CG1 3.95Å; M637-V640 HydrophobicContact CB-CB 3.83Å; M637-V640 HydrophobicContact CB-CG2 3.85Å; M637-V640 HydrophobicContact CE-CG2 3.6Å; M637-V640 WeakPolarHBondContact O-CA 3.48Å; M637-V640 WeakPolarHBondContact O-CB 3.47Å; M637-V640 PolarHBondContact O-N 3.13Å; M637-V640 HydrophobicContact SD-CG2 3.99Å; D638-V640 VanDerWaalsContact C-N 3.29Å; D638-V640 PolarHBondContact O-N 3.26Å; V640-I644 HydrophobicContact CG1-CD1 3.92Å; V640-I644 VanDerWaalsContact O-CB 3.3Å; V640-I644 WeakPolarHBondContact O-CB 3.12Å; V640-I644 WeakPolarHBondContact O-CG1 3.31Å; V640-I644 PolarHBondContact O-N 2.99Å
641	A	34.6	Very low	36.4	Very low	38 Å²	38	94.3 Å²	94.3	31%	0.314	48%	0.477	S	S	.	.	H	α-helix	trans	-60.5	-51	164	0	0	0	0	0	110.2	M632 M637 D638 I644 Q645	M632-A641 HydrophobicContact CE-CB 4.48Å; M637-A641 PolarHBondContact O-N 3.16Å; D638-A641 WeakPolarHBondContact O-CB 3.38Å; D638-A641 PolarHBondContact O-N 2.93Å; A641-I644 PolarHBondContact O-N 3.03Å; A641-Q645 WeakPolarHBondContact O-CB 3.34Å; A641-Q645 PolarHBondContact O-N 2.92Å
642	M	36.4	Very low	36.5	Very low	112 Å²	112	96.9 Å²	96.9	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-54.4	-53.6	171.8	-77.4	-73.1	-67.2	0	0	111.8	D638 I644 Q645 D646	D638-M642 WeakPolarHBondContact O-CB 3.5Å; D638-M642 WeakPolarHBondContact O-CG 3.29Å; D638-M642 PolarHBondContact O-N 2.78Å; M642-I644 VanDerWaalsContact C-N 3.31Å; M642-I644 PolarHBondContact O-N 3.01Å; M642-Q645 CarbonylContact O-C 3.57Å; M642-Q645 WeakPolarHBondContact O-CA 3.4Å; M642-Q645 PolarHBondContact O-N 2.74Å; M642-D646 PolarHBondContact O-N 3.5Å
643	A	37.1	Very low	36.6	Very low	46 Å²	46	99.9 Å²	99.9	38%	0.38	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-33	-178.6	0	0	0	0	0	113.6	D639 I647	D639-A643 VanDerWaalsContact O-CB 3.23Å; D639-A643 WeakPolarHBondContact O-CB 3.1Å; D639-A643 PolarHBondContact O-N 2.81Å; A643-I647 WeakPolarHBondContact O-CB 3.36Å; A643-I647 VanDerWaalsContact O-CD1 3.29Å; A643-I647 WeakPolarHBondContact O-CD1 3.28Å; A643-I647 WeakPolarHBondContact O-CG1 3.41Å; A643-I647 PolarHBondContact O-N 2.94Å; A643-I647 VanDerWaalsContact O-N 3.11Å
644	I	36.8	Very low	36.6	Very low	30 Å²	30	98.4 Å²	98.4	15%	0.154	51%	0.505	C	S	.	.	H	α-helix	trans	-77.4	-32.2	173.8	-75.7	168.4	0	0	0	111.1	M632 V640 A641 M642 I647 Q648	M632-I644 HydrophobicContact CE-CB 4.06Å; M632-I644 HydrophobicContact CE-CD1 3.68Å; M632-I644 HydrophobicContact CE-CG1 4.44Å; M632-I644 HydrophobicContact CE-CG2 4.11Å; M632-I644 HydrophobicContact SD-CD1 3.56Å; M632-I644 VanDerWaalsContact SD-CD1 3.56Å; V640-I644 HydrophobicContact CG1-CD1 3.92Å; V640-I644 VanDerWaalsContact O-CB 3.3Å; V640-I644 WeakPolarHBondContact O-CB 3.12Å; V640-I644 WeakPolarHBondContact O-CG1 3.31Å; V640-I644 PolarHBondContact O-N 2.99Å; A641-I644 PolarHBondContact O-N 3.03Å; M642-I644 VanDerWaalsContact C-N 3.31Å; M642-I644 PolarHBondContact O-N 3.01Å; I644-I647 CarbonylContact O-C 3.51Å; I644-I647 WeakPolarHBondContact O-CB 3.45Å; I644-I647 PolarHBondContact O-N 2.84Å; I644-Q648 WeakPolarHBondContact O-CB 3.3Å; I644-Q648 VanDerWaalsContact O-CG 3.24Å; I644-Q648 WeakPolarHBondContact O-CG 3.4Å; I644-Q648 PolarHBondContact O-N 3.46Å
645	Q	37	Very low	36.8	Very low	100 Å²	100	101.2 Å²	101.2	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-74	-27.5	174.4	-169.7	153.9	15.6	0	0	111.8	A641 M642 Q648 N649	A641-Q645 WeakPolarHBondContact O-CB 3.34Å; A641-Q645 PolarHBondContact O-N 2.92Å; M642-Q645 CarbonylContact O-C 3.57Å; M642-Q645 WeakPolarHBondContact O-CA 3.4Å; M642-Q645 PolarHBondContact O-N 2.74Å; Q645-Q648 PolarHBondContact O-N 2.89Å; Q645-N649 WeakPolarHBondContact CG-ND2 3.47Å; Q645-N649 WeakPolarHBondContact O-CA 3.37Å; Q645-N649 WeakPolarHBondContact O-CB 3.43Å; Q645-N649 PolarHBondContact O-N 3.5Å; Q645-N649 PolarHBondContact O-ND2 3.49Å
646	D	36.2	Very low	36.6	Very low	98 Å²	98	105.1 Å²	105.1	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-70.9	-36.2	165.9	-72.8	-29.2	0	0	0	111.2	M642 Q648 G650	M642-D646 PolarHBondContact O-N 3.5Å; D646-Q648 PolarHBondContact O-N 3.27Å; D646-G650 WeakPolarHBondContact O-CA 3.32Å; D646-G650 PolarHBondContact O-N 2.93Å
647	I	37.6	Very low	36.5	Very low	105 Å²	105	100 Å²	100	54%	0.538	52%	0.52	S	S	.	.	H	α-helix	trans	-69.6	-18.4	171.7	-71.4	164.4	0	0	0	112.3	A643 I644	A643-I647 WeakPolarHBondContact O-CB 3.36Å; A643-I647 VanDerWaalsContact O-CD1 3.29Å; A643-I647 WeakPolarHBondContact O-CD1 3.28Å; A643-I647 WeakPolarHBondContact O-CG1 3.41Å; A643-I647 PolarHBondContact O-N 2.94Å; A643-I647 VanDerWaalsContact O-N 3.11Å; I644-I647 CarbonylContact O-C 3.51Å; I644-I647 WeakPolarHBondContact O-CB 3.45Å; I644-I647 PolarHBondContact O-N 2.84Å
648	Q	35.3	Very low	36.3	Very low	138 Å²	138	104.7 Å²	104.7	65%	0.645	54%	0.544	S	S	*	.	H	α-helix	trans	-100.5	-42.2	178.3	-73.4	171.2	-4.6	0	0	113.3	I644 Q645 D646 G650	I644-Q648 WeakPolarHBondContact O-CB 3.3Å; I644-Q648 VanDerWaalsContact O-CG 3.24Å; I644-Q648 WeakPolarHBondContact O-CG 3.4Å; I644-Q648 PolarHBondContact O-N 3.46Å; Q645-Q648 PolarHBondContact O-N 2.89Å; D646-Q648 PolarHBondContact O-N 3.27Å; Q648-G650 VanDerWaalsContact C-N 3.33Å
649	N	40.6	Very low	36.2	Very low	104 Å²	104	106.6 Å²	106.6	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-73.6	-28.9	174.2	-67.5	-15.7	0	0	0	111.2	Q645 K651	Q645-N649 WeakPolarHBondContact CG-ND2 3.47Å; Q645-N649 WeakPolarHBondContact O-CA 3.37Å; Q645-N649 WeakPolarHBondContact O-CB 3.43Å; Q645-N649 PolarHBondContact O-N 3.5Å; Q645-N649 PolarHBondContact O-ND2 3.49Å; N649-K651 PolarHBondContact O-N 2.92Å
650	G	37.6	Very low	35.8	Very low	44 Å²	44	103.9 Å²	103.9	45%	0.454	54%	0.538	S	S	.	.	S	Bend	trans	-66.6	67.9	170.2	0	0	0	0	0	112.4	D646 Q648 D652	D646-G650 WeakPolarHBondContact O-CA 3.32Å; D646-G650 PolarHBondContact O-N 2.93Å; Q648-G650 VanDerWaalsContact C-N 3.33Å; G650-D652 PolarHBondContact O-N 3.32Å
651	K	35.8	Very low	35.6	Very low	195 Å²	195	109.9 Å²	109.9	85%	0.848	56%	0.561	S	S	*	*			trans	-50.3	130.2	152.9	-57.7	169.5	-173.5	173.7	0	106.5	N649	N649-K651 PolarHBondContact O-N 2.92Å
652	D	38.3	Very low	35.6	Very low	77 Å²	77	116.2 Å²	116.2	41%	0.412	59%	0.588	S	S	.	*			cis	-144.7	126.6	23.7	-174	-3.2	0	0	0	111.8	G650 L654 Y655	G650-D652 PolarHBondContact O-N 3.32Å; D652-L654 PolarHBondContact O-N 3.15Å; D652-L654 WeakPolarHBondContact OD1-CB 3.43Å; D652-L654 WeakPolarHBondContact OD1-CG 3.47Å; D652-L654 PolarHBondContact OD1-N 3.41Å; D652-Y655 HydrophobicContact CB-CD2 4.07Å; D652-Y655 PolarHBondContact O-N 2.9Å
653	L	39.8	Very low	35.4	Very low	120 Å²	120	116.4 Å²	116.4	63%	0.628	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-68.8	-13.4	178.3	-75.9	170.4	0	0	0	113.1	Y655	L653-Y655 PolarHBondContact O-N 3.07Å
654	L	36.4	Very low	35.1	Very low	131 Å²	131	125.6 Å²	125.6	69%	0.686	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-65.8	-17.5	173.3	-67.3	168.2	0	0	0	113.5	D652	D652-L654 PolarHBondContact O-N 3.15Å; D652-L654 WeakPolarHBondContact OD1-CB 3.43Å; D652-L654 WeakPolarHBondContact OD1-CG 3.47Å; D652-L654 PolarHBondContact OD1-N 3.41Å
655	Y	36.6	Very low	35.1	Very low	194 Å²	194	130.4 Å²	130.4	76%	0.761	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-96	8.1	-177.6	-78.8	-89.4	0	0	0	115.2	D652 L653 P657	D652-Y655 HydrophobicContact CB-CD2 4.07Å; D652-Y655 PolarHBondContact O-N 2.9Å; L653-Y655 PolarHBondContact O-N 3.07Å; Y655-P657 WeakPolarHBondContact O-CD 3.42Å
656	W	31.5	Very low	35	Very low	116 Å²	116	131.9 Å²	131.9	44%	0.439	67%	0.668	S	S	.	*	S	Bend	trans	-79.9	126.2	171.4	-89.8	34.8	0	0	0	111.6	I658 F659 S660	W656-I658 PolarHBondContact O-N 3.3Å; W656-F659 PolarHBondContact O-N 2.67Å; W656-S660 PolarHBondContact O-N 3.26Å
657	P	33.7	Very low	34.9	Very low	116 Å²	116	133.8 Å²	133.8	75%	0.753	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	15.4	-177.7	-24.2	35.1	0	0	0	117.4	Y655	Y655-P657 WeakPolarHBondContact O-CD 3.42Å
658	I	32.7	Very low	34.7	Very low	141 Å²	141	135.5 Å²	135.5	72%	0.723	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	-12.9	178.2	-50.9	177.8	0	0	0	110.4	W656	W656-I658 PolarHBondContact O-N 3.3Å
659	F	33.9	Very low	34.7	Very low	162 Å²	162	135.4 Å²	135.4	71%	0.711	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	3.1	175.8	-66	-67.4	0	0	0	113.6	W656 K661	W656-F659 PolarHBondContact O-N 2.67Å; F659-K661 VanDerWaalsContact C-N 3.27Å; F659-K661 PolarHBondContact O-N 2.67Å
660	S	29.1	Very low	34.3	Very low	75 Å²	75	137.5 Å²	137.5	52%	0.524	70%	0.695	S	S	.	*	S	Bend	trans	-72.1	78.3	174.8	58.2	0	0	0	0	111.8	W656	W656-S660 PolarHBondContact O-N 3.26Å
661	K	30.7	Very low	34.1	Very low	165 Å²	165	144.1 Å²	144.1	72%	0.717	71%	0.713	S	S	*	*			trans	56.8	101.7	173.4	-65.8	-166.6	170.7	-165	0	117.5	F659 D663	F659-K661 VanDerWaalsContact C-N 3.27Å; F659-K661 PolarHBondContact O-N 2.67Å; K661-D663 HydrophobicContact CB-CB 4.35Å; K661-D663 HydrophobicContact CD-CB 4.14Å; K661-D663 HydrophobicContact CG-CB 4.19Å
662	I	34.9	Very low	33.9	Very low	171 Å²	171	140.2 Å²	140.2	88%	0.877	70%	0.702	S	S	*	*				-85.7	114.5	116.5	-63.3	172.5	0	0	0	105.2
663	D	30.9	Very low	33.6	Very low	117 Å²	117	145.5 Å²	145.5	63%	0.626	73%	0.727	S	S	*	*			trans	-165.2	118.1	167.3	-102.8	-27.7	0	0	0	107.8	K661	K661-D663 HydrophobicContact CB-CB 4.35Å; K661-D663 HydrophobicContact CD-CB 4.14Å; K661-D663 HydrophobicContact CG-CB 4.19Å
664	N	32.6	Very low	33	Very low	238 Å²	238	147.8 Å²	147.8	100%	1.273	74%	0.735	S	S	*	*			trans	65	0	-165.7	-59.4	-22.5	0	0	0	114.9

Retrieved 664 of 664 residues in 607.2 ms (Link to these results)

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