A0A087WNY4_MOUSE Loading...

IKAROS family zinc finger 2

AlphaFold DB , UniProt , Accession A0A087WNY4, Species MOUSE (Mus musculus, Mouse), Gene Ikzf2, Length 532 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	52.8	Low	35.6	Very low	227 Å²	227	145.9 Å²	145.9	100%	1.118	81%	0.807	S	S	*	*				0	139.7	0	-61.3	176.7	-175.3	0	0	107.8
2	H	32.9	Very low	36.1	Very low	188 Å²	188	147.9 Å²	147.9	87%	0.87	81%	0.812	S	S	*	*			trans	-144.7	131.3	154.2	-97.1	-95.4	0	0	0	105.3
3	C	35.7	Very low	35.7	Very low	93 Å²	93	149.5 Å²	149.5	63%	0.628	82%	0.819	S	S	*	*			cis	81.8	72.6	32.2	-52.4	0	0	0	0	113.9
4	T	40.2	Very low	35.2	Very low	131 Å²	131	142.9 Å²	142.9	80%	0.804	80%	0.803	S	S	*	*				22.5	123	129.9	54.4	0	0	0	0	119
5	L	31.5	Very low	34.8	Very low	168 Å²	168	148 Å²	148	88%	0.88	81%	0.807	S	S	*	*				-162.5	-169	122.7	-109.5	167.6	0	0	0	110.7
6	T	32.9	Very low	34.6	Very low	113 Å²	113	146.7 Å²	146.7	69%	0.693	80%	0.797	S	S	*	*			trans	-127.4	164.1	-157.8	54.7	0	0	0	0	114.1
7	M	33.3	Very low	34.3	Very low	142 Å²	142	145.4 Å²	145.4	70%	0.7	80%	0.795	S	S	*	*			trans	88.7	126.2	152.7	-60.3	-104	-71.7	0	0	120.5
8	E	31.6	Very low	34.1	Very low	150 Å²	150	142.8 Å²	142.8	70%	0.701	79%	0.788	S	S	*	*				73.9	158.9	129.4	-69.5	-178.5	163.9	0	0	124.5
9	T	34.4	Very low	34	Very low	135 Å²	135	142.7 Å²	142.7	83%	0.828	79%	0.787	S	S	*	*			trans	94	143.6	162.5	64.6	0	0	0	0	120.2
10	D	33.6	Very low	34	Very low	164 Å²	164	142.5 Å²	142.5	88%	0.877	78%	0.784	S	S	*	*			trans	-101.6	-177.5	-171.6	-75.3	-69.8	0	0	0	113
11	A	32.4	Very low	33.9	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	78%	0.779	S	S	*	*			trans	83.4	91.9	159.1	0	0	0	0	0	118.4
12	I	41.9	Very low	32.9	Very low	170 Å²	170	139 Å²	139	87%	0.872	76%	0.763	S	S	*	*			trans	-12.3	123.2	145.5	-41.5	170.2	0	0	0	115.8
13	D	30.5	Very low	32.7	Very low	168 Å²	168	135.1 Å²	135.1	90%	0.898	76%	0.757	S	S	*	*			trans	-150.4	173.3	132.8	-143.2	-26.7	0	0	0	109.2
14	G	29.6	Very low	33.6	Very low	58 Å²	58	135.9 Å²	135.9	60%	0.598	76%	0.761	S	S	*	*			trans	-143.6	-163.7	-165.1	0	0	0	0	0	119.4
15	Y	29.3	Very low	33.4	Very low	219 Å²	219	138.9 Å²	138.9	86%	0.859	77%	0.766	S	S	*	*			trans	81.6	123.3	164.3	-93.1	-124.9	0	0	0	121.6
16	I	30.4	Very low	33.4	Very low	127 Å²	127	134.2 Å²	134.2	65%	0.651	76%	0.758	S	S	*	*			trans	89.2	106	135.4	-79	-176.1	0	0	0	122.5
17	T	31	Very low	33.7	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	76%	0.762	S	S	*	*			trans	65.5	162.4	141.2	67.2	0	0	0	0	119.8
18	C	29.3	Very low	33.8	Very low	100 Å²	100	138.2 Å²	138.2	68%	0.676	77%	0.767	S	S	*	*			cis	-149.9	151.9	19.5	39.2	0	0	0	0	116.1
19	D	32	Very low	33.7	Very low	141 Å²	141	135 Å²	135	75%	0.754	77%	0.767	S	S	*	*			trans	55.8	129	136.7	-48.4	-19.7	0	0	0	125.5
20	N	34.8	Very low	33.7	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	76%	0.764	S	S	*	*			trans	37.1	140.4	134	-78.1	43.3	0	0	0	122.8
21	E	32.1	Very low	33.7	Very low	146 Å²	146	135.8 Å²	135.8	68%	0.682	76%	0.762	S	S	*	*				-170.7	155.2	66.7	-85.2	-68.9	65.9	0	0	114
22	L	30.6	Very low	33.6	Very low	149 Å²	149	135.6 Å²	135.6	78%	0.78	76%	0.76	S	S	*	*			trans	56.8	143.3	149.8	-92.2	66.5	0	0	0	125.9
23	S	30.5	Very low	33	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	76%	0.758	S	S	*	*			trans	-100.1	-168.8	163.2	-45	0	0	0	0	110.7
24	P	52.7	Low	32.8	Very low	110 Å²	110	133.6 Å²	133.6	71%	0.714	75%	0.75	S	S	*	*				-161.6	-176.2	63.4	45.5	-21.6	0	0	0	119.6
25	E	36.2	Very low	32.7	Very low	194 Å²	194	137.5 Å²	137.5	91%	0.907	76%	0.756	S	S	*	*			trans	61.5	142.2	160	-41.1	-166.2	158.8	0	0	121.8
26	G	32.4	Very low	32.8	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	76%	0.755	S	S	*	*			cis	176	149.7	-9.5	0	0	0	0	0	116.3
27	E	38	Very low	32.7	Very low	163 Å²	163	132.5 Å²	132.5	76%	0.762	76%	0.759	S	S	*	*			trans	67.5	152.8	150.6	-57.2	-161.5	145.7	0	0	121.4
28	H	36.4	Very low	32.7	Very low	177 Å²	177	132.1 Å²	132.1	82%	0.819	76%	0.761	S	S	*	*			cis	-159.9	172.2	4.4	-130.5	0.7	0	0	0	115.7
29	A	30	Very low	32.8	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	77%	0.769	S	S	*	*			trans	80.8	81.2	148.9	0	0	0	0	0	125.8
30	N	34.2	Very low	33.5	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	77%	0.766	S	S	*	*				50.3	137.4	110	-81.2	-23	0	0	0	127.9
31	M	34	Very low	33.1	Very low	172 Å²	172	133.5 Å²	133.5	85%	0.847	77%	0.773	S	S	*	*				106.6	130.1	127.1	-84.8	171.7	-165.8	0	0	126
32	A	29.3	Very low	33	Very low	89 Å²	89	130.3 Å²	130.3	74%	0.736	78%	0.779	S	S	*	*			trans	92.9	96.9	130.2	0	0	0	0	0	125.6
33	I	30	Very low	33	Very low	160 Å²	160	131.1 Å²	131.1	82%	0.821	78%	0.779	S	S	*	*			trans	20.7	126	132.3	20.3	172.7	0	0	0	125.8
34	D	25.6	Very low	33.1	Very low	137 Å²	137	134.4 Å²	134.4	73%	0.733	78%	0.782	S	S	*	*				80.6	148.1	122	-111.7	-27.1	0	0	0	128
35	L	28.7	Very low	31.8	Very low	140 Å²	140	132.5 Å²	132.5	73%	0.733	78%	0.776	S	S	*	*			trans	53	120.4	156.8	-65.6	170.2	0	0	0	122.6
36	T	30.3	Very low	31.5	Very low	136 Å²	136	128.7 Å²	128.7	83%	0.834	77%	0.771	S	S	*	*				-174.5	148.7	101.7	24.1	0	0	0	0	115.5
37	S	29.2	Very low	32	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	77%	0.77	S	S	*	*			trans	-5.2	131.4	164.9	54.3	0	0	0	0	122
38	S	31	Very low	31.5	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	77%	0.767	S	S	*	*				-178.8	133.5	105.5	-77	0	0	0	0	113.8
39	T	31.3	Very low	31.2	Very low	136 Å²	136	127.4 Å²	127.4	83%	0.834	77%	0.767	S	S	*	*			trans	-126.8	157.8	156.2	64.1	0	0	0	0	107.7
40	P	45.7	Very low	31.1	Very low	106 Å²	106	130.9 Å²	130.9	69%	0.688	77%	0.77	S	S	*	*				-148.4	160.4	87.1	38.5	-21.3	0	0	0	116.5
41	N	27.6	Very low	30.9	Very low	166 Å²	166	130.6 Å²	130.6	89%	0.888	77%	0.774	S	S	*	*			trans	57.4	121.4	150.1	-59.1	-9.6	0	0	0	120.6
42	G	29.5	Very low	30.6	Very low	80 Å²	80	127 Å²	127	83%	0.825	77%	0.766	S	S	*	*			trans	173.2	10.3	173.8	0	0	0	0	0	116.5
43	Q	30.8	Very low	30.7	Very low	165 Å²	165	129 Å²	129	77%	0.771	77%	0.769	S	S	*	*			trans	-61.7	150.9	172.2	-76.6	174.4	-10.3	0	0	111.5
44	H	31.5	Very low	30.6	Very low	177 Å²	177	129 Å²	129	82%	0.819	77%	0.771	S	S	*	*			cis	-144.8	131.7	-0	-99	-55.7	0	0	0	107.3
45	A	27.4	Very low	30.9	Very low	69 Å²	69	127.7 Å²	127.7	57%	0.57	77%	0.772	S	S	*	*				85.3	94.6	83	0	0	0	0	0	117.2
46	S	29.3	Very low	30.8	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	78%	0.777	S	S	*	*				75.9	175.3	127.6	-48.1	0	0	0	0	119.1
47	P	42.8	Very low	30.5	Very low	107 Å²	107	128 Å²	128	70%	0.695	77%	0.767	S	S	*	*				-138.7	-172.8	-74.9	42.6	-26.7	0	0	0	114.6
48	S	26.5	Very low	30.4	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	77%	0.774	S	S	*	*			trans	69.4	156.6	152.3	67.1	0	0	0	0	119.5
49	H	30.7	Very low	30.2	Very low	175 Å²	175	132.1 Å²	132.1	81%	0.81	77%	0.767	S	S	*	*			cis	-144.2	144.2	-7	-130.2	-63.6	0	0	0	113.2
50	M	29	Very low	30	Very low	156 Å²	156	134.3 Å²	134.3	77%	0.768	77%	0.77	S	S	*	*			trans	-27.5	146.4	167.4	-61.8	-70.2	163.2	0	0	120.7
51	T	29.3	Very low	29.2	Very low	137 Å²	137	137.5 Å²	137.5	84%	0.84	78%	0.775	S	S	*	*				-161.4	96	126	16.2	0	0	0	0	109.7
52	S	27.9	Very low	29.1	Very low	96 Å²	96	135 Å²	135	67%	0.671	77%	0.771	S	S	*	*				74.8	99.4	95.3	-165.5	0	0	0	0	115.1
53	T	31	Very low	29.1	Very low	131 Å²	131	138.5 Å²	138.5	80%	0.804	77%	0.771	S	S	*	*			trans	-120.1	105.2	173.1	40.3	0	0	0	0	110.6	S55	T53-S55 PolarHBondContact O-N 3.14Å; T53-S55 VanDerWaalsContact O-N 3.11Å
54	N	28.8	Very low	29.2	Very low	160 Å²	160	140 Å²	140	86%	0.856	78%	0.778	S	S	*	*			trans	-78.2	96	-179.8	-85.1	-23.8	0	0	0	112.3
55	S	30.4	Very low	29.3	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	78%	0.781	S	S	*	*			trans	-108.3	111.5	165.6	-69.7	0	0	0	0	109.6	T53 K57	T53-S55 PolarHBondContact O-N 3.14Å; T53-S55 VanDerWaalsContact O-N 3.11Å; S55-K57 PolarHBondContact O-N 3.38Å
56	V	27	Very low	29.3	Very low	137 Å²	137	143.5 Å²	143.5	83%	0.83	80%	0.795	S	S	*	*			trans	-75.1	112.7	-179.7	179.1	0	0	0	0	110.2
57	K	24.8	Very low	29.2	Very low	146 Å²	146	144.8 Å²	144.8	64%	0.635	79%	0.793	S	S	*	*			trans	-82.7	141.7	171.1	-164.4	-172.9	-172.3	-156.5	0	109.3	S55 E59	S55-K57 PolarHBondContact O-N 3.38Å; K57-E59 HydrophobicContact CD-CG 4.43Å; K57-E59 WeakPolarHBondContact CE-OE1 3.47Å; K57-E59 WeakPolarHBondContact CE-OE2 3.49Å; K57-E59 HydrophobicContact CG-CG 4.47Å; K57-E59 IonicContact NZ-OE1 3.46Å; K57-E59 PolarHBondContact NZ-OE1 2.96Å; K57-E59 IonicContact NZ-OE2 2.65Å; K57-E59 PolarHBondContact NZ-OE2 3.18Å
58	L	25.9	Very low	28.7	Very low	164 Å²	164	150.2 Å²	150.2	86%	0.859	80%	0.8	S	S	*	*			trans	-124	123.9	166.6	-75.7	173.6	0	0	0	108.6
59	E	26.2	Very low	28.8	Very low	142 Å²	142	154 Å²	154	66%	0.664	81%	0.807	S	S	*	*			trans	-125.3	149.5	171.8	-76.6	169.7	137.7	0	0	108.3	K57	K57-E59 HydrophobicContact CD-CG 4.43Å; K57-E59 WeakPolarHBondContact CE-OE1 3.47Å; K57-E59 WeakPolarHBondContact CE-OE2 3.49Å; K57-E59 HydrophobicContact CG-CG 4.47Å; K57-E59 IonicContact NZ-OE1 3.46Å; K57-E59 PolarHBondContact NZ-OE1 2.96Å; K57-E59 IonicContact NZ-OE2 2.65Å; K57-E59 PolarHBondContact NZ-OE2 3.18Å
60	M	28.4	Very low	29.1	Very low	182 Å²	182	151.2 Å²	151.2	90%	0.897	80%	0.804	S	S	*	*			trans	-138	148.1	165.5	-74.9	-169.9	65.1	0	0	108.1
61	Q	28.5	Very low	29	Very low	173 Å²	173	152.3 Å²	152.3	81%	0.808	81%	0.812	S	S	*	*			trans	-72.5	159.8	-163.5	-67.3	104.3	-45.7	0	0	115.3
62	S	25.7	Very low	28.9	Very low	114 Å²	114	150.6 Å²	150.6	80%	0.797	81%	0.805	S	S	*	*			trans	-106.2	125.1	161.9	52.9	0	0	0	0	109.1
63	D	28.9	Very low	29	Very low	153 Å²	153	155.3 Å²	155.3	82%	0.818	81%	0.809	S	S	*	*			trans	-107.1	172.7	168.8	-64.5	-45.8	0	0	0	110.4
64	E	33.7	Very low	29	Very low	196 Å²	196	155.3 Å²	155.3	92%	0.916	80%	0.8	S	S	*	*			trans	-87.3	167.6	-140	-64.1	-167.3	126.9	0	0	119.4
65	E	33.4	Very low	29	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	80%	0.799	S	S	*	*			trans	-53.9	146.6	174.6	-176.5	168.1	-160.8	0	0	114.8
66	C	26.7	Very low	29.1	Very low	130 Å²	130	158 Å²	158	88%	0.878	80%	0.8	S	S	*	*			trans	-147.3	160.7	163.1	-157.7	0	0	0	0	110.1
67	D	28.5	Very low	29.3	Very low	143 Å²	143	158.8 Å²	158.8	77%	0.765	80%	0.798	S	S	*	*			trans	-89.7	175.7	-142.3	-126.7	-50.4	0	0	0	117.5
68	R	30.7	Very low	29.5	Very low	220 Å²	220	162 Å²	162	83%	0.83	81%	0.806	S	S	*	*			trans	-70.2	166.3	177.2	-42.4	176.5	-174.1	-176.8	0.7	110.4
69	Q	30	Very low	29.6	Very low	181 Å²	181	157.1 Å²	157.1	85%	0.846	80%	0.795	S	S	*	*			cis	-164.9	168.3	39.4	-126	175.9	-13.5	0	0	109.5
70	P	36.3	Very low	29.7	Very low	116 Å²	116	158.4 Å²	158.4	75%	0.753	80%	0.801	S	S	*	*			trans	-97.4	151.2	-178.5	36.6	-30.6	0	0	0	114.4
71	L	27.3	Very low	29.6	Very low	179 Å²	179	155.8 Å²	155.8	94%	0.937	79%	0.79	S	S	*	*			trans	-135.4	177.9	169.8	-74.7	177.5	0	0	0	111.7
72	S	27	Very low	29.9	Very low	100 Å²	100	156.4 Å²	156.4	70%	0.699	79%	0.793	S	S	*	*			trans	-142.2	153.2	-142.9	62.6	0	0	0	0	117.4
73	R	30.5	Very low	30	Very low	195 Å²	195	154.7 Å²	154.7	74%	0.736	79%	0.793	S	S	*	*			trans	65.8	134.5	155.7	-66.9	-176.9	81.6	168.9	-0.2	119.5
74	E	30.9	Very low	30	Very low	132 Å²	132	153.3 Å²	153.3	62%	0.617	80%	0.796	S	S	*	*			trans	63.3	148.5	144.9	-73.4	138.4	-156	0	0	117.1
75	D	28.1	Very low	29.7	Very low	156 Å²	156	148.6 Å²	148.6	83%	0.834	78%	0.784	S	S	*	*			cis	-136.3	177.5	16.6	-92	-53.9	0	0	0	113.5
76	E	32.3	Very low	29.6	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	79%	0.787	S	S	*	*			trans	-79.5	159.8	168.3	-54.6	-179.5	111.1	0	0	113.1
77	I	30.9	Very low	29.8	Very low	153 Å²	153	150.2 Å²	150.2	79%	0.785	78%	0.784	S	S	*	*				-177.4	149.3	129.3	-96.7	155.8	0	0	0	113.6
78	R	29.2	Very low	29.9	Very low	215 Å²	215	152 Å²	152	81%	0.811	79%	0.788	S	S	*	*			trans	-47	159.2	171.9	-73.1	150.1	-89.8	-135.1	-13.1	114.9
79	G	27.8	Very low	30.3	Very low	61 Å²	61	146.8 Å²	146.8	63%	0.629	78%	0.782	S	S	*	*			cis	149	174.5	1.7	0	0	0	0	0	111.7
80	H	29.5	Very low	30.4	Very low	169 Å²	169	145 Å²	145	78%	0.782	78%	0.778	S	S	*	*			trans	68.6	147.5	174.8	-66.3	-84.8	0	0	0	116.5
81	D	26	Very low	30.2	Very low	127 Å²	127	147.7 Å²	147.7	68%	0.679	78%	0.784	S	S	*	*			cis	-151.1	171.6	-0.9	-113.1	-22.7	0	0	0	114.5
82	E	33.9	Very low	30.3	Very low	186 Å²	186	146.7 Å²	146.7	87%	0.869	77%	0.774	S	S	*	*			trans	-6.7	158.8	163.1	-52.7	-177.2	160.4	0	0	121.4
83	G	28.5	Very low	30.6	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	77%	0.773	S	S	*	*			cis	-161.2	-174	5.6	0	0	0	0	0	109.9
84	S	28.5	Very low	30.7	Very low	124 Å²	124	142.6 Å²	142.6	87%	0.867	78%	0.776	S	S	*	*			cis	-156.5	154.6	37.6	176	0	0	0	0	111.7
85	S	27.2	Very low	30.9	Very low	97 Å²	97	145.5 Å²	145.5	68%	0.678	79%	0.79	S	S	*	*			trans	-74	160.6	171.3	-45.9	0	0	0	0	113.5
86	L	32.5	Very low	31.3	Very low	181 Å²	181	144.4 Å²	144.4	95%	0.948	79%	0.788	S	S	*	*				-141.9	146.6	124.2	-85.4	-173.6	0	0	0	109.5
87	E	29.5	Very low	31.2	Very low	173 Å²	173	140 Å²	140	81%	0.808	78%	0.781	S	S	*	*			trans	-99.2	156.6	-175.6	-74.7	-100.3	128.2	0	0	112.2
88	E	31.7	Very low	31.3	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	77%	0.769	S	S	*	*				162.8	160.3	128.1	-93.4	-157.3	166.6	0	0	111.6
89	P	38.3	Very low	31.7	Very low	110 Å²	110	134 Å²	134	71%	0.714	77%	0.767	S	S	*	*			cis	-129.4	175.3	-34.9	35.2	-18.9	0	0	0	112.6
90	L	33.2	Very low	32.4	Very low	144 Å²	144	141 Å²	141	75%	0.754	77%	0.774	S	S	*	*			trans	-76.8	142.9	-175.2	-67	163	0	0	0	114.5
91	I	31.8	Very low	32.4	Very low	172 Å²	172	140.8 Å²	140.8	88%	0.882	77%	0.771	S	S	*	*			trans	-132.7	95.7	144.8	-57.3	-177.8	0	0	0	108.5	S93	I91-S93 PolarHBondContact O-N 3.09Å
92	E	29	Very low	33.2	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.734	77%	0.773	S	S	*	*			trans	-66.7	118.1	162.2	-80.9	-174.9	121.1	0	0	108.6
93	S	33.4	Very low	33.2	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	76%	0.763	S	S	*	*				83.7	109.6	68.4	81.9	0	0	0	0	113.8	I91	I91-S93 PolarHBondContact O-N 3.09Å
94	S	32.2	Very low	33.7	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	76%	0.756	S	S	*	*	S	Bend	trans	-136.5	106.4	157.9	51.1	0	0	0	0	110	V96	S94-V96 PolarHBondContact O-N 2.94Å
95	E	35.5	Very low	34.4	Very low	193 Å²	193	140.7 Å²	140.7	90%	0.902	75%	0.747	S	S	*	*			trans	53.2	48.6	157.8	-56.7	-171.5	-171.8	0	0	118.5	A97	E95-A97 VanDerWaalsContact C-N 3.32Å; E95-A97 PolarHBondContact O-N 3.39Å; E95-A97 VanDerWaalsContact O-N 3.1Å
96	V	36.1	Very low	35.1	Very low	132 Å²	132	144 Å²	144	80%	0.8	75%	0.752	S	S	*	*			trans	-71.7	97	145.2	-178.1	0	0	0	0	107.2	S94 D98	S94-V96 PolarHBondContact O-N 2.94Å; V96-D98 VanDerWaalsContact C-N 3.28Å; V96-D98 PolarHBondContact O-N 3.35Å
97	A	30.4	Very low	35.9	Very low	79 Å²	79	137.9 Å²	137.9	65%	0.653	73%	0.733	S	S	*	*			trans	-66.2	84.1	177.5	0	0	0	0	0	111	E95 N99	E95-A97 VanDerWaalsContact C-N 3.32Å; E95-A97 PolarHBondContact O-N 3.39Å; E95-A97 VanDerWaalsContact O-N 3.1Å; A97-N99 VanDerWaalsContact C-N 3.27Å; A97-N99 PolarHBondContact O-N 3.24Å; A97-N99 PolarHBondContact O-ND2 3.05Å
98	D	33.9	Very low	36.9	Very low	101 Å²	101	138.2 Å²	138.2	54%	0.54	74%	0.735	S	S	.	*			trans	-67.7	82.5	-176.7	-166.9	12	0	0	0	110.6	V96 R100	V96-D98 VanDerWaalsContact C-N 3.28Å; V96-D98 PolarHBondContact O-N 3.35Å; D98-R100 PolarHBondContact O-N 3.32Å; D98-R100 WeakPolarHBondContact OD1-CG 3.37Å; D98-R100 IonicContact OD1-NE 3.8Å; D98-R100 IonicContact OD2-CZ 3.09Å; D98-R100 IonicContact OD2-NE 2.7Å; D98-R100 PolarHBondContact OD2-NE 2.98Å; D98-R100 IonicContact OD2-NH2 3.08Å; D98-R100 PolarHBondContact OD2-NH2 2.92Å
99	N	36.1	Very low	38.1	Very low	140 Å²	140	130.7 Å²	130.7	75%	0.749	71%	0.706	S	S	*	*			trans	-71.5	65.8	174	-91.8	-86.5	0	0	0	110.4	A97 K101	A97-N99 VanDerWaalsContact C-N 3.27Å; A97-N99 PolarHBondContact O-N 3.24Å; A97-N99 PolarHBondContact O-ND2 3.05Å; N99-K101 PolarHBondContact O-N 3.07Å
100	R	43.3	Very low	38.9	Very low	208 Å²	208	127 Å²	127	79%	0.785	69%	0.687	S	S	*	*			trans	-68.9	49.4	158.4	-61.5	-169.1	-168.4	-166.3	4.9	111.3	D98 V102	D98-R100 PolarHBondContact O-N 3.32Å; D98-R100 WeakPolarHBondContact OD1-CG 3.37Å; D98-R100 IonicContact OD1-NE 3.8Å; D98-R100 IonicContact OD2-CZ 3.09Å; D98-R100 IonicContact OD2-NE 2.7Å; D98-R100 PolarHBondContact OD2-NE 2.98Å; D98-R100 IonicContact OD2-NH2 3.08Å; D98-R100 PolarHBondContact OD2-NH2 2.92Å; R100-V102 VanDerWaalsContact C-N 3.32Å
101	K	30.4	Very low	40.4	Very low	165 Å²	165	124.3 Å²	124.3	72%	0.717	67%	0.673	S	S	*	*			trans	-96.5	77.2	153.5	-146.6	157.7	-168.4	167.9	0	107.3	N99 Q103	N99-K101 PolarHBondContact O-N 3.07Å; K101-Q103 HydrophobicContact CG-CG 4.08Å; K101-Q103 PolarHBondContact O-N 3.38Å
102	V	40.9	Very low	42	Very low	121 Å²	121	125.4 Å²	125.4	73%	0.733	67%	0.666	S	S	*	*			trans	-53.4	102.9	143.7	176.4	0	0	0	0	104	R100 D104	R100-V102 VanDerWaalsContact C-N 3.32Å; V102-D104 PolarHBondContact O-N 2.79Å; V102-D104 VanDerWaalsContact O-N 3.07Å
103	Q	36	Very low	43.9	Very low	137 Å²	137	120 Å²	120	64%	0.64	64%	0.642	S	S	*	*			trans	-74	102.3	174.9	-72.5	-177.2	-5.9	0	0	106.1	K101 L105	K101-Q103 HydrophobicContact CG-CG 4.08Å; K101-Q103 PolarHBondContact O-N 3.38Å; Q103-L105 HydrophobicContact CB-CG 4.23Å; Q103-L105 PolarHBondContact O-N 2.95Å
104	D	38.6	Very low	45.2	Very low	121 Å²	121	121.8 Å²	121.8	65%	0.647	65%	0.651	S	S	*	*			trans	-58.5	89.6	161.6	-81.3	-59.6	0	0	0	108.6	V102	V102-D104 PolarHBondContact O-N 2.79Å; V102-D104 VanDerWaalsContact O-N 3.07Å
105	L	42.6	Very low	47	Very low	132 Å²	132	121.9 Å²	121.9	69%	0.691	64%	0.643	S	S	*	*			trans	-103	78.8	165.8	-67.5	175.4	0	0	0	106.8	Q103 G107	Q103-L105 HydrophobicContact CB-CG 4.23Å; Q103-L105 PolarHBondContact O-N 2.95Å; L105-G107 PolarHBondContact O-N 3.22Å
106	Q	41.8	Very low	48.6	Very low	166 Å²	166	114.9 Å²	114.9	78%	0.776	62%	0.623	S	S	*	*			trans	-61	91.9	157.3	-79.6	78.4	14.1	0	0	108.4
107	G	49.7	Very low	50.4	Low	54 Å²	54	113.6 Å²	113.6	56%	0.557	61%	0.606	S	S	*	*			trans	115.9	-176.3	171.9	0	0	0	0	0	115.9	L105	L105-G107 PolarHBondContact O-N 3.22Å
108	E	50.5	Low	52.8	Low	179 Å²	179	111.1 Å²	111.1	84%	0.836	58%	0.582	S	S	*	*			trans	82.9	103.5	172.9	-58.9	-54.6	96	0	0	121.2	K137	E108-K137 PolarHBondContact O-NZ 3.22Å; E108-K137 VanDerWaalsContact O-NZ 3.17Å
109	G	55.5	Low	55.1	Low	23 Å²	23	110 Å²	110	24%	0.237	57%	0.572	C	S	.	*	S	Bend	trans	83.5	24.3	154.3	0	0	0	0	0	117	D121 K137	G109-D121 VanDerWaalsContact CA-OD2 3.22Å; G109-D121 WeakPolarHBondContact CA-OD2 3.46Å; G109-D121 VanDerWaalsContact O-OD2 3.11Å; G109-K137 WeakPolarHBondContact O-CE 3.37Å; G109-K137 PolarHBondContact O-NZ 3.02Å
110	G	56.3	Low	57.4	Low	32 Å²	32	103.4 Å²	103.4	33%	0.33	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	98.8	157.7	0	0	0	0	0	109.8	R112 L133	G110-R112 PolarHBondContact O-N 2.85Å; G110-R112 VanDerWaalsContact O-N 3.1Å; G110-L133 VanDerWaalsContact CA-CD2 3.41Å
111	I	64	Low	59.2	Low	88 Å²	88	96.9 Å²	96.9	45%	0.451	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	113.6	178.6	-54.9	166.7	0	0	0	107.2	L113 K119	I111-L113 PolarHBondContact O-N 3.34Å; I111-K119 HydrophobicContact CB-CD 4.34Å; I111-K119 HydrophobicContact CB-CG 3.76Å; I111-K119 VanDerWaalsContact CG2-CE 3.44Å; I111-K119 HydrophobicContact CG2-CG 4.39Å; I111-K119 PolarHBondContact N-O 3.07Å; I111-K119 VanDerWaalsContact N-O 3.14Å; I111-K119 WeakPolarHBondContact O-CG 3.34Å; I111-K119 PolarHBondContact O-N 2.84Å
112	R	65.7	Low	61.6	Low	196 Å²	196	93.6 Å²	93.6	74%	0.74	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.6	-176.7	-168.8	169.8	-174.3	151.3	-0.9	110	G110 L118	G110-R112 PolarHBondContact O-N 2.85Å; G110-R112 VanDerWaalsContact O-N 3.1Å; R112-L118 HydrophobicContact CB-CD2 4.01Å; R112-L118 HydrophobicContact CG-CD2 4.01Å
113	L	69.9	Low	63.5	Low	42 Å²	42	90.9 Å²	90.9	22%	0.22	50%	0.497	C	S	.	.			trans	-79.4	153.5	171.1	-76.5	82.8	0	0	0	109.7	I111 N115 G116 K117 K119 V126	I111-L113 PolarHBondContact O-N 3.34Å; L113-N115 PolarHBondContact O-N 2.76Å; L113-N115 VanDerWaalsContact O-N 3.08Å; L113-G116 PolarHBondContact O-N 3.33Å; L113-K117 PolarHBondContact N-O 3.11Å; L113-K119 HydrophobicContact CD1-CB 3.73Å; L113-K119 HydrophobicContact CD1-CD 4.1Å; L113-K119 HydrophobicContact CD1-CG 3.7Å; L113-V126 HydrophobicContact CD2-CG2 4.48Å
114	P	59.9	Low	65.5	Low	136 Å²	136	86.4 Å²	86.4	88%	0.883	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.8	173.9	24	-34.4	0	0	0	112.6	G116	P114-G116 PolarHBondContact O-N 3.39Å; P114-G116 VanDerWaalsContact O-N 3.12Å
115	N	69.2	Low	67.6	Low	115 Å²	115	85.6 Å²	85.6	62%	0.615	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	8.7	175.2	-35.3	74	0	0	0	114.3	L113 K117	L113-N115 PolarHBondContact O-N 2.76Å; L113-N115 VanDerWaalsContact O-N 3.08Å; N115-K117 PolarHBondContact O-N 3.24Å
116	G	69.4	Low	69.5	Low	46 Å²	46	82.8 Å²	82.8	47%	0.474	47%	0.469	S	S	.	.	S	Bend	trans	73.8	-14.4	-175.4	0	0	0	0	0	115.7	L113 P114	L113-G116 PolarHBondContact O-N 3.33Å; P114-G116 PolarHBondContact O-N 3.39Å; P114-G116 VanDerWaalsContact O-N 3.12Å
117	K	75.1	Confident	71.4	Confident	104 Å²	104	75.1 Å²	75.1	45%	0.452	43%	0.434	S	S	.	.			trans	-73.5	155.3	176.6	-58	178.9	-175.7	177.5	0	111.4	L113 N115 V126	L113-K117 PolarHBondContact N-O 3.11Å; N115-K117 PolarHBondContact O-N 3.24Å; K117-V126 HydrophobicContact CB-CG1 3.57Å; K117-V126 HydrophobicContact CD-CG1 3.82Å; K117-V126 HydrophobicContact CG-CG1 4.28Å
118	L	81.1	Confident	72.9	Confident	28 Å²	28	79.6 Å²	79.6	15%	0.147	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.7	-179.1	-57	175.3	0	0	0	109.6	R112 C127 P130 L133	R112-L118 HydrophobicContact CB-CD2 4.01Å; R112-L118 HydrophobicContact CG-CD2 4.01Å; L118-C127 PolarHBondContact N-O 2.94Å; L118-C127 VanDerWaalsContact N-O 3.08Å; L118-C127 WeakPolarHBondContact O-CA 3.48Å; L118-C127 WeakPolarHBondContact O-CB 3.37Å; L118-C127 PolarHBondContact O-N 2.89Å; L118-P130 HydrophobicContact CD1-CB 3.99Å; L118-L133 HydrophobicContact CB-CD2 4Å; L118-L133 HydrophobicContact CD1-CD2 4.32Å
119	K	82.1	Confident	74.3	Confident	78 Å²	78	72 Å²	72	34%	0.339	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	143.9	169.1	63.9	178.8	175.5	173.4	0	111.4	I111 L113 D121 M125 V126	I111-K119 HydrophobicContact CB-CD 4.34Å; I111-K119 HydrophobicContact CB-CG 3.76Å; I111-K119 VanDerWaalsContact CG2-CE 3.44Å; I111-K119 HydrophobicContact CG2-CG 4.39Å; I111-K119 PolarHBondContact N-O 3.07Å; I111-K119 VanDerWaalsContact N-O 3.14Å; I111-K119 WeakPolarHBondContact O-CG 3.34Å; I111-K119 PolarHBondContact O-N 2.84Å; L113-K119 HydrophobicContact CD1-CB 3.73Å; L113-K119 HydrophobicContact CD1-CD 4.1Å; L113-K119 HydrophobicContact CD1-CG 3.7Å; K119-D121 PolarHBondContact O-N 2.92Å; K119-M125 CarbonylContact C-O 3.58Å; K119-M125 WeakPolarHBondContact CA-O 3.26Å; K119-V126 HydrophobicContact CB-CG2 4.29Å
120	C	84.4	Confident	75.4	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.007	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	131.7	165.9	-174.8	0	0	0	0	110	V122 G124 M125 L133	C120-V122 PolarHBondContact SG-N 2.55Å; C120-V122 VanDerWaalsContact SG-N 3.37Å; C120-G124 WeakPolarHBondContact O-CA 3.37Å; C120-G124 PolarHBondContact O-N 3.12Å; C120-M125 PolarHBondContact N-O 3.38Å; C120-L133 HydrophobicContact CB-CD1 3.72Å
121	D	80.9	Confident	76.5	Confident	70 Å²	70	79.5 Å²	79.5	37%	0.374	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-48	166	46.7	0.8	0	0	0	113.4	G109 K119 K137	G109-D121 VanDerWaalsContact CA-OD2 3.22Å; G109-D121 WeakPolarHBondContact CA-OD2 3.46Å; G109-D121 VanDerWaalsContact O-OD2 3.11Å; K119-D121 PolarHBondContact O-N 2.92Å; D121-K137 WeakPolarHBondContact OD1-CE 3.46Å; D121-K137 IonicContact OD1-NZ 3.9Å; D121-K137 WeakPolarHBondContact OD2-CE 3.49Å; D121-K137 IonicContact OD2-NZ 2.74Å; D121-K137 PolarHBondContact OD2-NZ 2.86Å
122	V	80.4	Confident	77.3	Confident	96 Å²	96	79.2 Å²	79.2	58%	0.582	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-39.7	-173.3	-180	0	0	0	0	113.6	C120 H140	C120-V122 PolarHBondContact SG-N 2.55Å; C120-V122 VanDerWaalsContact SG-N 3.37Å; V122-H140 HydrophobicContact CG1-CB 4.28Å
123	C	80	Confident	78	Confident	64 Å²	64	70.4 Å²	70.4	43%	0.432	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	10.1	-172.9	75.1	0	0	0	0	115.5	M125 H136 H140	C123-M125 PolarHBondContact O-N 2.83Å; C123-H136 PolarHBondContact SG-NE2 3.38Å; C123-H140 PolarHBondContact SG-NE2 2.98Å
124	G	78.9	Confident	78.6	Confident	43 Å²	43	73.1 Å²	73.1	44%	0.443	43%	0.427	S	S	.	.			trans	70.7	-5.9	176.9	0	0	0	0	0	116.3	C120 V126	C120-G124 WeakPolarHBondContact O-CA 3.37Å; C120-G124 PolarHBondContact O-N 3.12Å; G124-V126 PolarHBondContact O-N 3.31Å
125	M	81.4	Confident	79.7	Confident	105 Å²	105	68.8 Å²	68.8	52%	0.517	40%	0.398	S	S	.	.			trans	-57.8	125.1	-177.2	-175.9	179.8	-68.4	0	0	111.6	K119 C120 C123 C127 H136	K119-M125 CarbonylContact C-O 3.58Å; K119-M125 WeakPolarHBondContact CA-O 3.26Å; C120-M125 PolarHBondContact N-O 3.38Å; C123-M125 PolarHBondContact O-N 2.83Å; M125-C127 PolarHBondContact O-N 3.16Å; M125-H136 VanDerWaalsContact SD-CE1 3.5Å
126	V	82.7	Confident	80.3	Confident	72 Å²	72	64.6 Å²	64.6	44%	0.436	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	106.5	-179.9	-177	0	0	0	0	110.4	L113 K117 K119 G124	L113-V126 HydrophobicContact CD2-CG2 4.48Å; K117-V126 HydrophobicContact CB-CG1 3.57Å; K117-V126 HydrophobicContact CD-CG1 3.82Å; K117-V126 HydrophobicContact CG-CG1 4.28Å; K119-V126 HydrophobicContact CB-CG2 4.29Å; G124-V126 PolarHBondContact O-N 3.31Å
127	C	81.4	Confident	80.7	Confident	5 Å²	5	65 Å²	65	3%	0.034	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	145.2	174.5	-59.9	0	0	0	0	111.6	L118 M125 G129 V132 L133	L118-C127 PolarHBondContact N-O 2.94Å; L118-C127 VanDerWaalsContact N-O 3.08Å; L118-C127 WeakPolarHBondContact O-CA 3.48Å; L118-C127 WeakPolarHBondContact O-CB 3.37Å; L118-C127 PolarHBondContact O-N 2.89Å; M125-C127 PolarHBondContact O-N 3.16Å; C127-G129 VanDerWaalsContact C-N 3.33Å; C127-G129 PolarHBondContact O-N 3.13Å; C127-V132 HydrophobicContact CB-CB 4.29Å; C127-V132 HydrophobicContact CB-CG1 4.14Å; C127-L133 HydrophobicContact CB-CB 3.91Å
128	I	81.3	Confident	81.1	Confident	149 Å²	149	62.2 Å²	62.2	76%	0.764	35%	0.35	S	S	*	.	S	Bend	trans	-75.8	-21.6	-177.3	-61.1	169.4	0	0	0	112.1
129	G	81.3	Confident	81.1	Confident	19 Å²	19	63.7 Å²	63.7	20%	0.196	36%	0.363	C	S	.	.	S	Bend	trans	-167.5	171.9	176.9	0	0	0	0	0	113.5	C127 N131 V132 L133	C127-G129 VanDerWaalsContact C-N 3.33Å; C127-G129 PolarHBondContact O-N 3.13Å; G129-N131 PolarHBondContact O-N 3.27Å; G129-V132 WeakPolarHBondContact O-CB 3.26Å; G129-V132 PolarHBondContact O-N 3.36Å; G129-V132 VanDerWaalsContact O-N 3.14Å; G129-L133 PolarHBondContact O-N 3.25Å; G129-L133 VanDerWaalsContact O-N 3.1Å
130	P	77.4	Confident	80.9	Confident	89 Å²	89	63.6 Å²	63.6	58%	0.578	36%	0.364	S	S	*	.	H	α-helix	trans	-63.3	-39.4	-169.8	23.4	-33.7	0	0	0	113.4	L118 V132 L133 M134	L118-P130 HydrophobicContact CD1-CB 3.99Å; P130-V132 VanDerWaalsContact C-N 3.28Å; P130-V132 PolarHBondContact O-N 3.17Å; P130-L133 PolarHBondContact O-N 2.95Å; P130-L133 VanDerWaalsContact O-N 3.16Å; P130-M134 WeakPolarHBondContact O-CB 3.46Å; P130-M134 PolarHBondContact O-N 3.01Å
131	N	79.4	Confident	80.7	Confident	123 Å²	123	67.6 Å²	67.6	66%	0.658	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-34.8	177.1	-68.1	-16	0	0	0	112.4	G129 V135	G129-N131 PolarHBondContact O-N 3.27Å; N131-V135 WeakPolarHBondContact O-CB 3.43Å; N131-V135 WeakPolarHBondContact O-CG2 3.45Å; N131-V135 PolarHBondContact O-N 3.35Å; N131-V135 VanDerWaalsContact O-N 3.16Å
132	V	80.8	Confident	80.5	Confident	83 Å²	83	66.7 Å²	66.7	50%	0.503	40%	0.395	S	S	.	.	H	α-helix	trans	-70.1	-43.2	175.2	-178	0	0	0	0	110	C127 G129 P130 V135 H136	C127-V132 HydrophobicContact CB-CB 4.29Å; C127-V132 HydrophobicContact CB-CG1 4.14Å; G129-V132 WeakPolarHBondContact O-CB 3.26Å; G129-V132 PolarHBondContact O-N 3.36Å; G129-V132 VanDerWaalsContact O-N 3.14Å; P130-V132 VanDerWaalsContact C-N 3.28Å; P130-V132 PolarHBondContact O-N 3.17Å; V132-V135 PolarHBondContact O-N 2.83Å; V132-H136 VanDerWaalsContact O-CB 3.22Å; V132-H136 WeakPolarHBondContact O-CB 3.5Å; V132-H136 PolarHBondContact O-N 3.33Å
133	L	81.7	Confident	80.5	Confident	11 Å²	11	66.4 Å²	66.4	6%	0.058	39%	0.388	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176.6	177.8	60.1	0	0	0	112.4	G110 L118 C120 C127 G129 P130 H136 K137	G110-L133 VanDerWaalsContact CA-CD2 3.41Å; L118-L133 HydrophobicContact CB-CD2 4Å; L118-L133 HydrophobicContact CD1-CD2 4.32Å; C120-L133 HydrophobicContact CB-CD1 3.72Å; C127-L133 HydrophobicContact CB-CB 3.91Å; G129-L133 PolarHBondContact O-N 3.25Å; G129-L133 VanDerWaalsContact O-N 3.1Å; P130-L133 PolarHBondContact O-N 2.95Å; P130-L133 VanDerWaalsContact O-N 3.16Å; L133-H136 CarbonylContact O-C 3.54Å; L133-H136 WeakPolarHBondContact O-CB 3.32Å; L133-H136 PolarHBondContact O-N 3.29Å; L133-K137 HydrophobicContact CD1-CG 4.28Å; L133-K137 PolarHBondContact O-N 3.48Å
134	M	82	Confident	80.5	Confident	98 Å²	98	68.8 Å²	68.8	48%	0.483	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-48.5	176.6	-176.9	-163.8	-67.9	0	0	111.2	P130 H136 K137 R138	P130-M134 WeakPolarHBondContact O-CB 3.46Å; P130-M134 PolarHBondContact O-N 3.01Å; M134-H136 VanDerWaalsContact C-N 3.28Å; M134-H136 PolarHBondContact O-N 2.9Å; M134-K137 PolarHBondContact O-N 2.8Å; M134-R138 PolarHBondContact O-N 3.38Å
135	V	81.8	Confident	80.6	Confident	45 Å²	45	69.7 Å²	69.7	27%	0.273	39%	0.385	S	S	.	.	H	α-helix	trans	-66.3	-32.1	177.7	169.5	0	0	0	0	111.8	N131 V132 Q157	N131-V135 WeakPolarHBondContact O-CB 3.43Å; N131-V135 WeakPolarHBondContact O-CG2 3.45Å; N131-V135 PolarHBondContact O-N 3.35Å; N131-V135 VanDerWaalsContact O-N 3.16Å; V132-V135 PolarHBondContact O-N 2.83Å; V135-Q157 HydrophobicContact CG1-CG 3.68Å; V135-Q157 HydrophobicContact CG2-CG 4.44Å
136	H	81.8	Confident	80.7	Confident	28 Å²	28	67.6 Å²	67.6	13%	0.13	37%	0.374	C	S	.	.	H	α-helix	trans	-68.9	-44.1	172.3	173.2	77.6	0	0	0	112	C123 M125 V132 L133 M134 R138 S139 H140	C123-H136 PolarHBondContact SG-NE2 3.38Å; M125-H136 VanDerWaalsContact SD-CE1 3.5Å; V132-H136 VanDerWaalsContact O-CB 3.22Å; V132-H136 WeakPolarHBondContact O-CB 3.5Å; V132-H136 PolarHBondContact O-N 3.33Å; L133-H136 CarbonylContact O-C 3.54Å; L133-H136 WeakPolarHBondContact O-CB 3.32Å; L133-H136 PolarHBondContact O-N 3.29Å; M134-H136 VanDerWaalsContact C-N 3.28Å; M134-H136 PolarHBondContact O-N 2.9Å; H136-R138 PolarHBondContact O-N 3.44Å; H136-S139 VanDerWaalsContact O-CB 3.32Å; H136-S139 WeakPolarHBondContact O-CB 3.2Å; H136-S139 PolarHBondContact O-N 3.4Å; H136-S139 PolarHBondContact O-OG 2.92Å; H136-H140 AromaticContact CD2-NE2 3.73Å; H136-H140 AromaticContact CE1-NE2 3.61Å; H136-H140 AromaticContact NE2-CD2 3.91Å; H136-H140 AromaticContact NE2-CE1 3.89Å; H136-H140 AromaticContact NE2-NE2 3Å; H136-H140 PolarHBondContact NE2-NE2 2.97Å
137	K	79.4	Confident	80.8	Confident	53 Å²	53	68.8 Å²	68.8	23%	0.23	37%	0.374	C	S	.	.	H	α-helix	trans	-56.2	-35.3	176	-82.4	-168.6	164.2	-158.4	0	112.8	E108 G109 D121 L133 M134 S139 H140 T141	E108-K137 PolarHBondContact O-NZ 3.22Å; E108-K137 VanDerWaalsContact O-NZ 3.17Å; G109-K137 WeakPolarHBondContact O-CE 3.37Å; G109-K137 PolarHBondContact O-NZ 3.02Å; D121-K137 WeakPolarHBondContact OD1-CE 3.46Å; D121-K137 IonicContact OD1-NZ 3.9Å; D121-K137 WeakPolarHBondContact OD2-CE 3.49Å; D121-K137 IonicContact OD2-NZ 2.74Å; D121-K137 PolarHBondContact OD2-NZ 2.86Å; L133-K137 HydrophobicContact CD1-CG 4.28Å; L133-K137 PolarHBondContact O-N 3.48Å; M134-K137 PolarHBondContact O-N 2.8Å; K137-S139 PolarHBondContact O-N 2.92Å; K137-S139 VanDerWaalsContact O-N 3.12Å; K137-H140 WeakPolarHBondContact O-CA 3.19Å; K137-H140 WeakPolarHBondContact O-CB 3.5Å; K137-H140 PolarHBondContact O-N 3.43Å; K137-T141 PolarHBondContact O-N 3.03Å
138	R	83.8	Confident	80.8	Confident	46 Å²	46	68.7 Å²	68.7	17%	0.174	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-18.6	172.8	-65.9	-166.6	179.1	127.6	11.3	114.8	M134 H136 H140 G142 E143 T156	M134-R138 PolarHBondContact O-N 3.38Å; H136-R138 PolarHBondContact O-N 3.44Å; R138-H140 VanDerWaalsContact C-N 3.34Å; R138-G142 WeakPolarHBondContact O-CA 3.32Å; R138-G142 PolarHBondContact O-N 3.12Å; R138-E143 HydrophobicContact CB-CB 4.22Å; R138-E143 HydrophobicContact CG-CB 3.9Å; R138-E143 IonicContact NE-OE2 2.7Å; R138-E143 PolarHBondContact NE-OE2 3.44Å; R138-T156 HydrophobicContact CB-CG2 4.38Å; R138-T156 PolarHBondContact NH1-O 3.31Å
139	S	79.3	Confident	80.8	Confident	60 Å²	60	69.2 Å²	69.2	42%	0.42	38%	0.378	S	S	.	.	H	α-helix	trans	-78.3	-18.9	172.2	73.3	0	0	0	0	113.6	H136 K137	H136-S139 VanDerWaalsContact O-CB 3.32Å; H136-S139 WeakPolarHBondContact O-CB 3.2Å; H136-S139 PolarHBondContact O-N 3.4Å; H136-S139 PolarHBondContact O-OG 2.92Å; K137-S139 PolarHBondContact O-N 2.92Å; K137-S139 VanDerWaalsContact O-N 3.12Å
140	H	79.4	Confident	80.5	Confident	75 Å²	75	74.5 Å²	74.5	35%	0.347	40%	0.398	S	S	.	.	H	α-helix	trans	-92.4	-45.5	172.7	-56.5	-50.9	0	0	0	111.7	V122 C123 H136 K137 R138 G142	V122-H140 HydrophobicContact CG1-CB 4.28Å; C123-H140 PolarHBondContact SG-NE2 2.98Å; H136-H140 AromaticContact CD2-NE2 3.73Å; H136-H140 AromaticContact CE1-NE2 3.61Å; H136-H140 AromaticContact NE2-CD2 3.91Å; H136-H140 AromaticContact NE2-CE1 3.89Å; H136-H140 AromaticContact NE2-NE2 3Å; H136-H140 PolarHBondContact NE2-NE2 2.97Å; K137-H140 WeakPolarHBondContact O-CA 3.19Å; K137-H140 WeakPolarHBondContact O-CB 3.5Å; K137-H140 PolarHBondContact O-N 3.43Å; R138-H140 VanDerWaalsContact C-N 3.34Å; H140-G142 VanDerWaalsContact C-N 3.31Å; H140-G142 PolarHBondContact O-N 3.35Å
141	T	79.1	Confident	80.6	Confident	86 Å²	86	73.6 Å²	73.6	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-76.3	-17.4	178.6	63.8	0	0	0	0	113.5	K137 E143	K137-T141 PolarHBondContact O-N 3.03Å; T141-E143 WeakPolarHBondContact CB-OE1 3.35Å; T141-E143 PolarHBondContact O-N 2.94Å; T141-E143 VanDerWaalsContact OG1-CD 3.26Å; T141-E143 WeakPolarHBondContact OG1-CG 3.11Å; T141-E143 PolarHBondContact OG1-OE1 3.17Å
142	G	77.1	Confident	80.5	Confident	50 Å²	50	70.3 Å²	70.3	52%	0.515	39%	0.388	S	S	.	.			trans	76.6	2.6	-177.9	0	0	0	0	0	114.6	R138 H140 R144	R138-G142 WeakPolarHBondContact O-CA 3.32Å; R138-G142 PolarHBondContact O-N 3.12Å; H140-G142 VanDerWaalsContact C-N 3.31Å; H140-G142 PolarHBondContact O-N 3.35Å; G142-R144 WeakPolarHBondContact O-CG 3.42Å; G142-R144 PolarHBondContact O-N 3.37Å
143	E	80.3	Confident	80.4	Confident	91 Å²	91	67.7 Å²	67.7	43%	0.425	38%	0.375	S	S	.	.			trans	-56.5	125.3	178.8	-79	163	-120.8	0	0	112.9	R138 T141	R138-E143 HydrophobicContact CB-CB 4.22Å; R138-E143 HydrophobicContact CG-CB 3.9Å; R138-E143 IonicContact NE-OE2 2.7Å; R138-E143 PolarHBondContact NE-OE2 3.44Å; T141-E143 WeakPolarHBondContact CB-OE1 3.35Å; T141-E143 PolarHBondContact O-N 2.94Å; T141-E143 VanDerWaalsContact OG1-CD 3.26Å; T141-E143 WeakPolarHBondContact OG1-CG 3.11Å; T141-E143 PolarHBondContact OG1-OE1 3.17Å
144	R	80.9	Confident	80.4	Confident	114 Å²	114	68.7 Å²	68.7	43%	0.43	38%	0.383	S	S	.	.			trans	-128	72.4	177.6	-67.9	167.6	78.6	142.5	-1.6	110.4	G142 F146 H147 S154 F155 T156	G142-R144 WeakPolarHBondContact O-CG 3.42Å; G142-R144 PolarHBondContact O-N 3.37Å; R144-F146 VanDerWaalsContact C-N 3.25Å; R144-F146 PolarHBondContact O-N 2.98Å; R144-F146 VanDerWaalsContact O-N 3.15Å; R144-H147 PolarHBondContact O-CE1 2.96Å; R144-S154 VanDerWaalsContact CB-CB 3.47Å; R144-S154 VanDerWaalsContact CZ-O 3.23Å; R144-S154 PolarHBondContact NE-O 3.44Å; R144-S154 PolarHBondContact NH2-O 3.02Å; R144-S154 WeakPolarHBondContact O-CB 3.45Å; R144-F155 CarbonylContact C-O 3.58Å; R144-F155 VanDerWaalsContact CA-O 3.29Å; R144-F155 WeakPolarHBondContact CA-O 3.48Å; R144-T156 HydrophobicContact CG-CG2 3.97Å
145	P	80.9	Confident	80.5	Confident	61 Å²	61	65.8 Å²	65.8	40%	0.396	37%	0.368	S	S	.	.			trans	-64.1	-23.8	-168.6	-23.1	34.9	0	0	0	115.2	H147	P145-H147 PolarHBondContact O-ND1 3.5Å
146	F	83.8	Confident	80.5	Confident	62 Å²	62	65.4 Å²	65.4	27%	0.272	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	105	-169.5	-57.6	-79.4	0	0	0	111	R144 S154 F155 Q157 K158 L161	R144-F146 VanDerWaalsContact C-N 3.25Å; R144-F146 PolarHBondContact O-N 2.98Å; R144-F146 VanDerWaalsContact O-N 3.15Å; F146-S154 CarbonylContact O-C 3.57Å; F146-S154 WeakPolarHBondContact O-CA 3.47Å; F146-F155 HydrophobicContact CB-CB 4.34Å; F146-F155 WeakPolarHBondContact CD2-O 3.35Å; F146-F155 PolarHBondContact N-O 3.41Å; F146-F155 PolarHBondContact O-N 3.17Å; F146-Q157 VanDerWaalsContact CD2-CA 3.49Å; F146-K158 HydrophobicContact CD1-CB 3.81Å; F146-K158 HydrophobicContact CD1-CG 4.21Å; F146-K158 HydrophobicContact CE1-CB 3.68Å; F146-K158 HydrophobicContact CE1-CG 4.24Å; F146-K158 HydrophobicContact CG-CB 4.34Å; F146-K158 HydrophobicContact CZ-CB 4.09Å; F146-L161 HydrophobicContact CB-CB 4.02Å; F146-L161 HydrophobicContact CB-CD2 3.9Å
147	H	82.9	Confident	80.6	Confident	97 Å²	97	67.9 Å²	67.9	45%	0.449	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145.1	-172.6	-67	77.7	0	0	0	112.6	R144 P145 S154 L161	R144-H147 PolarHBondContact O-CE1 2.96Å; P145-H147 PolarHBondContact O-ND1 3.5Å; H147-S154 PolarHBondContact CD2-OG 2.96Å; H147-S154 PolarHBondContact NE2-OG 3.36Å; H147-L161 WeakPolarHBondContact O-CD1 3.46Å; H147-L161 VanDerWaalsContact O-CD2 3.25Å; H147-L161 WeakPolarHBondContact O-CD2 3.5Å
148	C	82.9	Confident	80.6	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.02	39%	0.394	C	S	.	.			trans	-95.5	107.3	173.1	-171.8	0	0	0	0	111.3	Q150 C151 G152 A153 L161 H164	C148-Q150 PolarHBondContact O-N 3.31Å; C148-C151 PolarHBondContact O-N 2.75Å; C148-C151 VanDerWaalsContact O-N 3.14Å; C148-G152 WeakPolarHBondContact O-CA 3.48Å; C148-G152 PolarHBondContact O-N 3.16Å; C148-A153 HydrophobicContact CB-CB 4.24Å; C148-A153 WeakPolarHBondContact CB-O 3.37Å; C148-A153 PolarHBondContact N-O 2.94Å; C148-L161 HydrophobicContact CB-CD1 3.61Å; C148-H164 PolarHBondContact SG-CD2 3.42Å; C148-H164 PolarHBondContact SG-NE2 3.26Å; C148-H164 VanDerWaalsContact SG-NE2 3.38Å
149	N	79.8	Confident	80.5	Confident	159 Å²	159	71.8 Å²	71.8	85%	0.85	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.6	-178.4	-57.7	12.9	0	0	0	113.5
150	Q	76.8	Confident	80.6	Confident	131 Å²	131	70.5 Å²	70.5	61%	0.612	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.3	-179.2	-68.7	177.1	-20	0	0	114.4	C148 H168	C148-Q150 PolarHBondContact O-N 3.31Å; Q150-H168 VanDerWaalsContact OE1-CB 3.24Å; Q150-H168 PolarHBondContact OE1-CD2 3.32Å; Q150-H168 VanDerWaalsContact OE1-CG 3.29Å
151	C	78.1	Confident	80.7	Confident	69 Å²	69	68 Å²	68	47%	0.466	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.1	8.2	-179.9	66.7	0	0	0	0	116.1	C148 A153 H164 H168	C148-C151 PolarHBondContact O-N 2.75Å; C148-C151 VanDerWaalsContact O-N 3.14Å; C151-A153 PolarHBondContact O-N 3.21Å; C151-H164 PolarHBondContact SG-NE2 3.32Å; C151-H168 PolarHBondContact SG-NE2 3.09Å
152	G	77.4	Confident	80.8	Confident	54 Å²	54	68.4 Å²	68.4	56%	0.557	38%	0.384	S	S	*	.			trans	74.6	-4.1	-179.2	0	0	0	0	0	115.7	C148 S154	C148-G152 WeakPolarHBondContact O-CA 3.48Å; C148-G152 PolarHBondContact O-N 3.16Å; G152-S154 PolarHBondContact O-N 2.91Å
153	A	78.9	Confident	80.7	Confident	29 Å²	29	71.3 Å²	71.3	24%	0.24	38%	0.379	C	S	.	.			trans	-65.4	115.5	-174.8	0	0	0	0	0	112.9	C148 C151 F155	C148-A153 HydrophobicContact CB-CB 4.24Å; C148-A153 WeakPolarHBondContact CB-O 3.37Å; C148-A153 PolarHBondContact N-O 2.94Å; C151-A153 PolarHBondContact O-N 3.21Å; A153-F155 HydrophobicContact CB-CE2 3.8Å; A153-F155 HydrophobicContact CB-CZ 3.96Å; A153-F155 WeakPolarHBondContact O-CD2 3.22Å; A153-F155 WeakPolarHBondContact O-CE2 3.39Å
154	S	82.5	Confident	80.8	Confident	31 Å²	31	68.5 Å²	68.5	22%	0.217	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	147.4	177.3	-38.2	0	0	0	0	112.7	R144 F146 H147 G152	R144-S154 VanDerWaalsContact CB-CB 3.47Å; R144-S154 VanDerWaalsContact CZ-O 3.23Å; R144-S154 PolarHBondContact NE-O 3.44Å; R144-S154 PolarHBondContact NH2-O 3.02Å; R144-S154 WeakPolarHBondContact O-CB 3.45Å; F146-S154 CarbonylContact O-C 3.57Å; F146-S154 WeakPolarHBondContact O-CA 3.47Å; H147-S154 PolarHBondContact CD2-OG 2.96Å; H147-S154 PolarHBondContact NE2-OG 3.36Å; G152-S154 PolarHBondContact O-N 2.91Å
155	F	83.3	Confident	80.6	Confident	38 Å²	38	66.3 Å²	66.3	17%	0.167	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.2	179.4	-61.2	-84.2	0	0	0	113	R144 F146 A153 Q157 N160 L161 H164	R144-F155 CarbonylContact C-O 3.58Å; R144-F155 VanDerWaalsContact CA-O 3.29Å; R144-F155 WeakPolarHBondContact CA-O 3.48Å; F146-F155 HydrophobicContact CB-CB 4.34Å; F146-F155 WeakPolarHBondContact CD2-O 3.35Å; F146-F155 PolarHBondContact N-O 3.41Å; F146-F155 PolarHBondContact O-N 3.17Å; A153-F155 HydrophobicContact CB-CE2 3.8Å; A153-F155 HydrophobicContact CB-CZ 3.96Å; A153-F155 WeakPolarHBondContact O-CD2 3.22Å; A153-F155 WeakPolarHBondContact O-CE2 3.39Å; F155-Q157 VanDerWaalsContact C-N 3.32Å; F155-Q157 PolarHBondContact O-N 2.97Å; F155-N160 HydrophobicContact CB-CB 4.03Å; F155-N160 HydrophobicContact CD1-CB 3.86Å; F155-N160 HydrophobicContact CG-CB 4.13Å; F155-L161 HydrophobicContact CB-CB 4.5Å; F155-L161 HydrophobicContact CD2-CB 3.95Å; F155-L161 HydrophobicContact CD2-CD1 3.99Å; F155-L161 HydrophobicContact CE2-CD1 4.17Å; F155-L161 HydrophobicContact CG-CB 4.46Å; F155-H164 HydrophobicContact CE1-CB 4.21Å; F155-H164 HydrophobicContact CE2-CB 3.81Å; F155-H164 AromaticContact CE2-CD2 3.56Å; F155-H164 AromaticContact CE2-CG 3.59Å; F155-H164 HydrophobicContact CZ-CB 3.51Å; F155-H164 AromaticContact CZ-CD2 3.76Å; F155-H164 AromaticContact CZ-CG 3.33Å; F155-H164 AromaticContact CZ-ND1 3.62Å
156	T	81.7	Confident	80.3	Confident	37 Å²	37	70 Å²	70	23%	0.227	37%	0.372	C	S	.	.	S	Bend	trans	-74	-17	177.4	54.8	0	0	0	0	114.2	R138 R144	R138-T156 HydrophobicContact CB-CG2 4.38Å; R138-T156 PolarHBondContact NH1-O 3.31Å; R144-T156 HydrophobicContact CG-CG2 3.97Å
157	Q	83.4	Confident	79.8	Confident	80 Å²	80	71.2 Å²	71.2	37%	0.374	38%	0.38	S	S	.	.	S	Bend	trans	-142.8	140.9	-174	-56.8	173.3	19.9	0	0	112.2	V135 F146 F155 G159 N160 L161	V135-Q157 HydrophobicContact CG1-CG 3.68Å; V135-Q157 HydrophobicContact CG2-CG 4.44Å; F146-Q157 VanDerWaalsContact CD2-CA 3.49Å; F155-Q157 VanDerWaalsContact C-N 3.32Å; F155-Q157 PolarHBondContact O-N 2.97Å; Q157-G159 VanDerWaalsContact C-N 3.31Å; Q157-G159 PolarHBondContact O-N 3.46Å; Q157-N160 HydrophobicContact CB-CB 4.45Å; Q157-N160 WeakPolarHBondContact O-CB 3.38Å; Q157-N160 PolarHBondContact O-N 2.77Å; Q157-L161 PolarHBondContact O-N 3.49Å
158	K	79.9	Confident	79.3	Confident	136 Å²	136	70.5 Å²	70.5	59%	0.591	38%	0.377	S	S	*	.	H	α-helix	trans	-56.5	-39.4	176.6	-167	173.9	-178.3	175.7	0	113.3	F146 N160 L161 L162	F146-K158 HydrophobicContact CD1-CB 3.81Å; F146-K158 HydrophobicContact CD1-CG 4.21Å; F146-K158 HydrophobicContact CE1-CB 3.68Å; F146-K158 HydrophobicContact CE1-CG 4.24Å; F146-K158 HydrophobicContact CG-CB 4.34Å; F146-K158 HydrophobicContact CZ-CB 4.09Å; K158-N160 VanDerWaalsContact C-N 3.27Å; K158-N160 PolarHBondContact O-N 2.87Å; K158-L161 PolarHBondContact O-N 3.33Å; K158-L162 HydrophobicContact CG-CD1 4.33Å; K158-L162 WeakPolarHBondContact O-CG 3.4Å; K158-L162 PolarHBondContact O-N 3.4Å
159	G	81.3	Confident	78.6	Confident	44 Å²	44	73.2 Å²	73.2	45%	0.454	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-28.2	177.3	0	0	0	0	0	114	Q157 R163	Q157-G159 VanDerWaalsContact C-N 3.31Å; Q157-G159 PolarHBondContact O-N 3.46Å; G159-R163 VanDerWaalsContact O-CB 3.31Å; G159-R163 WeakPolarHBondContact O-CB 3.37Å; G159-R163 PolarHBondContact O-N 2.85Å; G159-R163 VanDerWaalsContact O-N 3.14Å
160	N	81.3	Confident	77.8	Confident	33 Å²	33	67.6 Å²	67.6	18%	0.176	38%	0.376	C	S	.	.	H	α-helix	trans	-72.6	-43	174.4	-68.8	-23.8	0	0	0	111	F155 Q157 K158 R163 H164	F155-N160 HydrophobicContact CB-CB 4.03Å; F155-N160 HydrophobicContact CD1-CB 3.86Å; F155-N160 HydrophobicContact CG-CB 4.13Å; Q157-N160 HydrophobicContact CB-CB 4.45Å; Q157-N160 WeakPolarHBondContact O-CB 3.38Å; Q157-N160 PolarHBondContact O-N 2.77Å; K158-N160 VanDerWaalsContact C-N 3.27Å; K158-N160 PolarHBondContact O-N 2.87Å; N160-R163 PolarHBondContact O-N 2.75Å; N160-R163 PolarHBondContact OD1-NH2 3.34Å; N160-H164 WeakPolarHBondContact O-CB 3.32Å; N160-H164 PolarHBondContact O-N 2.75Å
161	L	82.8	Confident	77.2	Confident	22 Å²	22	67.6 Å²	67.6	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-59.9	-50.1	173.2	173.3	61.2	0	0	0	111.8	F146 H147 C148 F155 Q157 K158 R163 H164 I165	F146-L161 HydrophobicContact CB-CB 4.02Å; F146-L161 HydrophobicContact CB-CD2 3.9Å; H147-L161 WeakPolarHBondContact O-CD1 3.46Å; H147-L161 VanDerWaalsContact O-CD2 3.25Å; H147-L161 WeakPolarHBondContact O-CD2 3.5Å; C148-L161 HydrophobicContact CB-CD1 3.61Å; F155-L161 HydrophobicContact CB-CB 4.5Å; F155-L161 HydrophobicContact CD2-CB 3.95Å; F155-L161 HydrophobicContact CD2-CD1 3.99Å; F155-L161 HydrophobicContact CE2-CD1 4.17Å; F155-L161 HydrophobicContact CG-CB 4.46Å; Q157-L161 PolarHBondContact O-N 3.49Å; K158-L161 PolarHBondContact O-N 3.33Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 2.87Å; L161-H164 CarbonylContact O-C 3.1Å; L161-H164 WeakPolarHBondContact O-CA 3.49Å; L161-H164 WeakPolarHBondContact O-CB 3.44Å; L161-H164 PolarHBondContact O-N 3.02Å; L161-I165 HydrophobicContact CD1-CD1 3.87Å; L161-I165 HydrophobicContact CD1-CG1 4.01Å; L161-I165 HydrophobicContact CG-CD1 3.87Å; L161-I165 HydrophobicContact CG-CG1 4.44Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 2.85Å
162	L	80.1	Confident	76.9	Confident	96 Å²	96	70 Å²	70	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-60.4	-39.1	179.2	-69.5	172.6	0	0	0	112.5	K158 H164 K166	K158-L162 HydrophobicContact CG-CD1 4.33Å; K158-L162 WeakPolarHBondContact O-CG 3.4Å; K158-L162 PolarHBondContact O-N 3.4Å; L162-H164 VanDerWaalsContact C-N 3.32Å; L162-K166 PolarHBondContact O-N 2.96Å
163	R	76.4	Confident	76.7	Confident	111 Å²	111	71.6 Å²	71.6	42%	0.419	38%	0.379	S	S	.	.	H	α-helix	trans	-65.4	-34.3	172.8	170.6	166.7	56.1	176.5	-3.7	112.6	G159 N160 L161	G159-R163 VanDerWaalsContact O-CB 3.31Å; G159-R163 WeakPolarHBondContact O-CB 3.37Å; G159-R163 PolarHBondContact O-N 2.85Å; G159-R163 VanDerWaalsContact O-N 3.14Å; N160-R163 PolarHBondContact O-N 2.75Å; N160-R163 PolarHBondContact OD1-NH2 3.34Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 2.87Å
164	H	80.8	Confident	76.6	Confident	31 Å²	31	73 Å²	73	14%	0.144	38%	0.38	C	S	.	.	H	α-helix	trans	-75.1	-37.9	177.3	167.2	82.9	0	0	0	112.5	C148 C151 F155 N160 L161 L162 K166 L167 H168	C148-H164 PolarHBondContact SG-CD2 3.42Å; C148-H164 PolarHBondContact SG-NE2 3.26Å; C148-H164 VanDerWaalsContact SG-NE2 3.38Å; C151-H164 PolarHBondContact SG-NE2 3.32Å; F155-H164 HydrophobicContact CE1-CB 4.21Å; F155-H164 HydrophobicContact CE2-CB 3.81Å; F155-H164 AromaticContact CE2-CD2 3.56Å; F155-H164 AromaticContact CE2-CG 3.59Å; F155-H164 HydrophobicContact CZ-CB 3.51Å; F155-H164 AromaticContact CZ-CD2 3.76Å; F155-H164 AromaticContact CZ-CG 3.33Å; F155-H164 AromaticContact CZ-ND1 3.62Å; N160-H164 WeakPolarHBondContact O-CB 3.32Å; N160-H164 PolarHBondContact O-N 2.75Å; L161-H164 CarbonylContact O-C 3.1Å; L161-H164 WeakPolarHBondContact O-CA 3.49Å; L161-H164 WeakPolarHBondContact O-CB 3.44Å; L161-H164 PolarHBondContact O-N 3.02Å; L162-H164 VanDerWaalsContact C-N 3.32Å; H164-K166 VanDerWaalsContact C-N 3.25Å; H164-K166 PolarHBondContact O-N 2.69Å; H164-L167 WeakPolarHBondContact O-CA 3.39Å; H164-L167 WeakPolarHBondContact O-CB 3.44Å; H164-L167 WeakPolarHBondContact O-CG 3.49Å; H164-L167 PolarHBondContact O-N 3Å; H164-H168 AromaticContact CE1-NE2 3.9Å; H164-H168 AromaticContact NE2-NE2 3.36Å; H164-H168 PolarHBondContact NE2-NE2 3.34Å
165	I	78.1	Confident	76.4	Confident	68 Å²	68	79.2 Å²	79.2	35%	0.349	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-38.3	173.9	-67.3	165	0	0	0	110.6	L161 L167 H168	L161-I165 HydrophobicContact CD1-CD1 3.87Å; L161-I165 HydrophobicContact CD1-CG1 4.01Å; L161-I165 HydrophobicContact CG-CD1 3.87Å; L161-I165 HydrophobicContact CG-CG1 4.44Å; L161-I165 WeakPolarHBondContact O-CG1 3.49Å; L161-I165 PolarHBondContact O-N 2.85Å; I165-L167 PolarHBondContact O-N 3.15Å; I165-H168 PolarHBondContact O-N 2.9Å
166	K	74.4	Confident	76.1	Confident	139 Å²	139	78 Å²	78	60%	0.604	40%	0.399	S	S	*	.	H	α-helix	trans	-65.3	3.6	169.7	-66.5	-171.8	178.9	-163.1	0	114.8	L162 H164 R184	L162-K166 PolarHBondContact O-N 2.96Å; H164-K166 VanDerWaalsContact C-N 3.25Å; H164-K166 PolarHBondContact O-N 2.69Å; K166-R184 WeakPolarHBondContact O-CD 3.11Å
167	L	72.6	Confident	75.7	Confident	87 Å²	87	81 Å²	81	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-89.4	-30	166.5	-55.3	177.1	0	0	0	112.4	H164 I165 R184	H164-L167 WeakPolarHBondContact O-CA 3.39Å; H164-L167 WeakPolarHBondContact O-CB 3.44Å; H164-L167 WeakPolarHBondContact O-CG 3.49Å; H164-L167 PolarHBondContact O-N 3Å; I165-L167 PolarHBondContact O-N 3.15Å; L167-R184 VanDerWaalsContact CA-NH1 3.3Å; L167-R184 PolarHBondContact O-NH1 2.64Å; L167-R184 PolarHBondContact O-NH2 3.38Å
168	H	72.8	Confident	74.9	Confident	82 Å²	82	82.8 Å²	82.8	38%	0.38	43%	0.426	S	S	.	.	H	α-helix	trans	-75.3	-33.8	179.3	-63.7	-61.5	0	0	0	112.2	Q150 C151 H164 I165 G170	Q150-H168 VanDerWaalsContact OE1-CB 3.24Å; Q150-H168 PolarHBondContact OE1-CD2 3.32Å; Q150-H168 VanDerWaalsContact OE1-CG 3.29Å; C151-H168 PolarHBondContact SG-NE2 3.09Å; H164-H168 AromaticContact CE1-NE2 3.9Å; H164-H168 AromaticContact NE2-NE2 3.36Å; H164-H168 PolarHBondContact NE2-NE2 3.34Å; I165-H168 PolarHBondContact O-N 2.9Å; H168-G170 PolarHBondContact O-N 2.91Å
169	S	67.8	Low	74.5	Confident	61 Å²	61	77.6 Å²	77.6	43%	0.427	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.2	179.6	66.2	0	0	0	0	115.4	E171	S169-E171 PolarHBondContact O-N 3.07Å
170	G	63.8	Low	74.1	Confident	40 Å²	40	81.6 Å²	81.6	41%	0.412	43%	0.427	S	S	.	.			trans	77	-45	176.1	0	0	0	0	0	114.9	H168 R184	H168-G170 PolarHBondContact O-N 2.91Å; G170-R184 VanDerWaalsContact C-NH2 3.32Å; G170-R184 VanDerWaalsContact CA-NH2 3.33Å; G170-R184 PolarHBondContact O-NE 3.01Å; G170-R184 VanDerWaalsContact O-NE 3.12Å; G170-R184 PolarHBondContact O-NH2 3.35Å
171	E	64.1	Low	73.6	Confident	132 Å²	132	84.4 Å²	84.4	62%	0.617	44%	0.436	S	S	*	.			trans	-41.6	141.8	-173.2	-67.6	169.6	177.2	0	0	115.7	S169 R184	S169-E171 PolarHBondContact O-N 3.07Å; E171-R184 WeakPolarHBondContact O-CD 3.49Å; E171-R184 WeakPolarHBondContact O-CG 3.35Å; E171-R184 PolarHBondContact O-NE 2.93Å
172	K	71.9	Confident	73.3	Confident	118 Å²	118	84.6 Å²	84.6	51%	0.513	44%	0.441	S	S	.	.			trans	-131	70.6	175.1	-70.4	168.9	172.9	179.1	0	110.3	F174 A182 C183 R184	K172-F174 PolarHBondContact O-N 2.79Å; K172-A182 HydrophobicContact CB-CB 3.81Å; K172-A182 HydrophobicContact CD-CB 4.2Å; K172-A182 WeakPolarHBondContact CD-O 3.24Å; K172-C183 CarbonylContact C-O 3.57Å; K172-C183 WeakPolarHBondContact CA-O 3.37Å; K172-R184 HydrophobicContact CG-CG 4.16Å
173	P	73.4	Confident	73.2	Confident	88 Å²	88	80.5 Å²	80.5	57%	0.571	42%	0.42	S	S	*	.			trans	-65.5	-19.8	-172.2	24	-34	0	0	0	114.5	K175	P173-K175 PolarHBondContact O-N 2.79Å
174	F	77	Confident	73.2	Confident	59 Å²	59	79.3 Å²	79.3	26%	0.259	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	85.6	-178.7	-56.7	-77.4	0	0	0	110.8	K172 A182 C183 R185 R186 L189	K172-F174 PolarHBondContact O-N 2.79Å; F174-A182 WeakPolarHBondContact O-CA 3.44Å; F174-C183 WeakPolarHBondContact CB-O 3.39Å; F174-C183 PolarHBondContact N-O 2.82Å; F174-C183 PolarHBondContact O-N 2.76Å; F174-C183 PolarHBondContact O-SG 3.14Å; F174-C183 VanDerWaalsContact O-SG 3.41Å; F174-R185 VanDerWaalsContact CD2-N 3.34Å; F174-R186 HydrophobicContact CD1-CB 4.06Å; F174-R186 HydrophobicContact CD1-CG 4.48Å; F174-R186 HydrophobicContact CE1-CB 3.72Å; F174-R186 HydrophobicContact CE1-CG 4.24Å; F174-R186 HydrophobicContact CE2-CB 4.48Å; F174-R186 HydrophobicContact CZ-CB 3.95Å; F174-L189 HydrophobicContact CB-CB 4.03Å; F174-L189 HydrophobicContact CB-CD2 3.91Å
175	K	78.1	Confident	72.9	Confident	162 Å²	162	82.8 Å²	82.8	70%	0.704	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	148.4	173.4	-59.1	-178.7	-178.4	177.8	0	111.1	P173 A182 L189	P173-K175 PolarHBondContact O-N 2.79Å; K175-A182 HydrophobicContact CB-CB 4.48Å; K175-A182 HydrophobicContact CG-CB 3.97Å; K175-L189 WeakPolarHBondContact O-CD2 3.46Å
176	C	77	Confident	72.8	Confident	12 Å²	12	88 Å²	88	8%	0.081	44%	0.443	C	S	.	.			trans	-83	137.2	169.8	-172.1	0	0	0	0	110.8	F178 C179 Y181 L189 H192 H196	C176-F178 PolarHBondContact O-N 3.02Å; C176-F178 PolarHBondContact SG-N 3.04Å; C176-F178 VanDerWaalsContact SG-N 3.4Å; C176-C179 VanDerWaalsContact O-O 3.06Å; C176-Y181 WeakPolarHBondContact CB-O 3.34Å; C176-Y181 PolarHBondContact N-O 3.12Å; C176-L189 HydrophobicContact CB-CD1 4.1Å; C176-H192 WeakPolarHBondContact CB-NE2 3.46Å; C176-H192 VanDerWaalsContact SG-CD2 3.58Å; C176-H192 PolarHBondContact SG-NE2 3.36Å; C176-H196 PolarHBondContact SG-NE2 3.49Å; C176-H196 VanDerWaalsContact SG-NE2 3.39Å
177	P	72.7	Confident	73	Confident	100 Å²	100	85.7 Å²	85.7	65%	0.649	44%	0.437	S	S	*	.	S	Bend	trans	-74.9	-10.9	173.1	31.1	-36	0	0	0	113.5	L193	P177-L193 HydrophobicContact CG-CD2 4.34Å
178	F	66.7	Low	73.3	Confident	117 Å²	117	83.1 Å²	83.1	51%	0.513	43%	0.428	S	S	.	.	S	Bend	trans	-110.9	-5.3	-174.9	-55.8	-59.4	0	0	0	114.5	C176 L193 H196 C207	C176-F178 PolarHBondContact O-N 3.02Å; C176-F178 PolarHBondContact SG-N 3.04Å; C176-F178 VanDerWaalsContact SG-N 3.4Å; F178-L193 HydrophobicContact CD2-CD2 3.93Å; F178-L193 HydrophobicContact CE2-CD2 3.99Å; F178-H196 HydrophobicContact CD2-CB 4.1Å; F178-H196 AromaticContact CD2-CG 3.93Å; F178-C207 CarbonylContact O-C 3.58Å
179	C	71.6	Confident	73.6	Confident	27 Å²	27	80.4 Å²	80.4	18%	0.182	42%	0.416	C	S	.	.	S	Bend	trans	-165.6	171.2	174.1	67.8	0	0	0	0	112.4	C176 Y181 H192 C207	C176-C179 VanDerWaalsContact O-O 3.06Å; C179-Y181 PolarHBondContact O-N 3.48Å; C179-Y181 WeakPolarHBondContact SG-CB 3.43Å; C179-H192 PolarHBondContact SG-NE2 2.97Å; C179-H192 VanDerWaalsContact SG-NE2 3.38Å; C179-C207 HydrophobicContact CB-CB 4.4Å; C179-C207 VanDerWaalsContact CB-O 3.28Å; C179-C207 WeakPolarHBondContact CB-O 3.25Å
180	S	72.6	Confident	74.2	Confident	128 Å²	128	80.6 Å²	80.6	90%	0.895	42%	0.415	S	S	*	.	S	Bend	trans	-66.1	4.2	176.9	54.7	0	0	0	0	115.7	A182	S180-A182 PolarHBondContact O-N 2.96Å
181	Y	70.8	Confident	74.8	Confident	92 Å²	92	80.6 Å²	80.6	36%	0.361	42%	0.415	S	S	.	.			trans	-68.2	121.8	176.2	-177.5	-97	0	0	0	111.2	C176 C179 C183 H192	C176-Y181 WeakPolarHBondContact CB-O 3.34Å; C176-Y181 PolarHBondContact N-O 3.12Å; C179-Y181 PolarHBondContact O-N 3.48Å; C179-Y181 WeakPolarHBondContact SG-CB 3.43Å; Y181-C183 HydrophobicContact CE1-CB 3.77Å; Y181-H192 HydrophobicContact CD1-CB 4.12Å; Y181-H192 AromaticContact CD1-CD2 3.37Å; Y181-H192 WeakPolarHBondContact CD1-CD2 3.39Å; Y181-H192 AromaticContact CD1-CE1 3.77Å; Y181-H192 AromaticContact CD1-CG 3.46Å; Y181-H192 VanDerWaalsContact CD1-CG 3.46Å; Y181-H192 AromaticContact CD1-ND1 3.71Å; Y181-H192 AromaticContact CD1-NE2 3.56Å; Y181-H192 HydrophobicContact CE1-CB 3.85Å; Y181-H192 AromaticContact CE1-CG 3.69Å; Y181-H192 AromaticContact CG-CE1 3.7Å; Y181-H192 AromaticContact CG-ND1 3.93Å; Y181-H192 AromaticContact CG-NE2 3.77Å
182	A	76.4	Confident	75.5	Confident	26 Å²	26	75 Å²	75	22%	0.215	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.8	174.3	0	0	0	0	0	110.8	K172 F174 K175 S180	K172-A182 HydrophobicContact CB-CB 3.81Å; K172-A182 HydrophobicContact CD-CB 4.2Å; K172-A182 WeakPolarHBondContact CD-O 3.24Å; F174-A182 WeakPolarHBondContact O-CA 3.44Å; K175-A182 HydrophobicContact CB-CB 4.48Å; K175-A182 HydrophobicContact CG-CB 3.97Å; S180-A182 PolarHBondContact O-N 2.96Å
183	C	77.9	Confident	75.5	Confident	11 Å²	11	71.8 Å²	71.8	7%	0.074	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	169.7	-174.9	69.3	0	0	0	0	112.6	K172 F174 Y181 R185 A188	K172-C183 CarbonylContact C-O 3.57Å; K172-C183 WeakPolarHBondContact CA-O 3.37Å; F174-C183 WeakPolarHBondContact CB-O 3.39Å; F174-C183 PolarHBondContact N-O 2.82Å; F174-C183 PolarHBondContact O-N 2.76Å; F174-C183 PolarHBondContact O-SG 3.14Å; F174-C183 VanDerWaalsContact O-SG 3.41Å; Y181-C183 HydrophobicContact CE1-CB 3.77Å; C183-R185 PolarHBondContact SG-O 3.08Å; C183-A188 HydrophobicContact CB-CB 4.44Å
184	R	76.3	Confident	75.5	Confident	85 Å²	85	76.8 Å²	76.8	32%	0.321	38%	0.384	S	S	.	.	S	Bend	trans	-96.2	7	-175.7	-44.6	-155.7	173.3	124.2	-9.3	113.9	K166 L167 G170 E171 K172	K166-R184 WeakPolarHBondContact O-CD 3.11Å; L167-R184 VanDerWaalsContact CA-NH1 3.3Å; L167-R184 PolarHBondContact O-NH1 2.64Å; L167-R184 PolarHBondContact O-NH2 3.38Å; G170-R184 VanDerWaalsContact C-NH2 3.32Å; G170-R184 VanDerWaalsContact CA-NH2 3.33Å; G170-R184 PolarHBondContact O-NE 3.01Å; G170-R184 VanDerWaalsContact O-NE 3.12Å; G170-R184 PolarHBondContact O-NH2 3.35Å; E171-R184 WeakPolarHBondContact O-CD 3.49Å; E171-R184 WeakPolarHBondContact O-CG 3.35Å; E171-R184 PolarHBondContact O-NE 2.93Å; K172-R184 HydrophobicContact CG-CG 4.16Å
185	R	74.3	Confident	75	Confident	104 Å²	104	76.4 Å²	76.4	39%	0.392	39%	0.387	S	S	.	.			trans	-141.8	121.5	-166.6	-92.5	175	75.2	170.6	-0.2	111.5	F174 C183 D187 A188 L189	F174-R185 VanDerWaalsContact CD2-N 3.34Å; C183-R185 PolarHBondContact SG-O 3.08Å; R185-D187 VanDerWaalsContact C-N 3.26Å; R185-D187 VanDerWaalsContact CB-OD1 3.27Å; R185-D187 WeakPolarHBondContact CB-OD1 3.48Å; R185-D187 WeakPolarHBondContact CG-OD1 3.35Å; R185-D187 IonicContact CZ-OD1 3.2Å; R185-D187 IonicContact CZ-OD2 2.74Å; R185-D187 IonicContact NE-OD1 3.02Å; R185-D187 PolarHBondContact NE-OD1 3.16Å; R185-D187 VanDerWaalsContact NE-OD1 3.08Å; R185-D187 IonicContact NE-OD2 3.98Å; R185-D187 PolarHBondContact NE-OD2 3.21Å; R185-D187 IonicContact NH2-OD1 3.31Å; R185-D187 IonicContact NH2-OD2 3.48Å; R185-D187 PolarHBondContact NH2-OD2 3.17Å; R185-D187 PolarHBondContact O-N 3.02Å; R185-A188 HydrophobicContact CB-CB 3.65Å; R185-A188 WeakPolarHBondContact O-CB 3.37Å; R185-A188 PolarHBondContact O-N 3.4Å; R185-A188 VanDerWaalsContact O-N 3.12Å; R185-L189 PolarHBondContact O-N 2.99Å
186	R	77.3	Confident	74.5	Confident	179 Å²	179	69.2 Å²	69.2	68%	0.675	36%	0.356	S	S	*	.	H	α-helix	trans	-56.8	-41.2	175.7	-174.1	-179.9	-74.3	173.6	-3.2	111.5	F174 L189 T190	F174-R186 HydrophobicContact CD1-CB 4.06Å; F174-R186 HydrophobicContact CD1-CG 4.48Å; F174-R186 HydrophobicContact CE1-CB 3.72Å; F174-R186 HydrophobicContact CE1-CG 4.24Å; F174-R186 HydrophobicContact CE2-CB 4.48Å; F174-R186 HydrophobicContact CZ-CB 3.95Å; R186-L189 WeakPolarHBondContact O-CB 3.48Å; R186-L189 PolarHBondContact O-N 3.07Å; R186-T190 PolarHBondContact O-N 2.7Å; R186-T190 PolarHBondContact O-OG1 3.45Å; R186-T190 VanDerWaalsContact O-OG1 3.07Å
187	D	78.4	Confident	74	Confident	90 Å²	90	71.9 Å²	71.9	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-66.5	-34.7	177.9	63.4	-63.7	0	0	0	113	R185 T190 G191	R185-D187 VanDerWaalsContact C-N 3.26Å; R185-D187 VanDerWaalsContact CB-OD1 3.27Å; R185-D187 WeakPolarHBondContact CB-OD1 3.48Å; R185-D187 WeakPolarHBondContact CG-OD1 3.35Å; R185-D187 IonicContact CZ-OD1 3.2Å; R185-D187 IonicContact CZ-OD2 2.74Å; R185-D187 IonicContact NE-OD1 3.02Å; R185-D187 PolarHBondContact NE-OD1 3.16Å; R185-D187 VanDerWaalsContact NE-OD1 3.08Å; R185-D187 IonicContact NE-OD2 3.98Å; R185-D187 PolarHBondContact NE-OD2 3.21Å; R185-D187 IonicContact NH2-OD1 3.31Å; R185-D187 IonicContact NH2-OD2 3.48Å; R185-D187 PolarHBondContact NH2-OD2 3.17Å; R185-D187 PolarHBondContact O-N 3.02Å; D187-T190 PolarHBondContact O-N 3.15Å; D187-G191 PolarHBondContact O-N 3.38Å
188	A	78.1	Confident	73.1	Confident	33 Å²	33	73.3 Å²	73.3	27%	0.273	38%	0.381	S	S	.	.	H	α-helix	trans	-68.5	-38.5	172.4	0	0	0	0	0	111.5	C183 R185 G191 H192	C183-A188 HydrophobicContact CB-CB 4.44Å; R185-A188 HydrophobicContact CB-CB 3.65Å; R185-A188 WeakPolarHBondContact O-CB 3.37Å; R185-A188 PolarHBondContact O-N 3.4Å; R185-A188 VanDerWaalsContact O-N 3.12Å; A188-G191 PolarHBondContact O-N 3.29Å; A188-H192 VanDerWaalsContact O-CB 3.24Å; A188-H192 WeakPolarHBondContact O-CB 3.45Å; A188-H192 PolarHBondContact O-N 3.31Å
189	L	79.7	Confident	72.5	Confident	24 Å²	24	71.3 Å²	71.3	13%	0.126	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-45.9	171.1	177.7	60.2	0	0	0	111.3	F174 K175 C176 R185 R186 G191 H192 L193	F174-L189 HydrophobicContact CB-CB 4.03Å; F174-L189 HydrophobicContact CB-CD2 3.91Å; K175-L189 WeakPolarHBondContact O-CD2 3.46Å; C176-L189 HydrophobicContact CB-CD1 4.1Å; R185-L189 PolarHBondContact O-N 2.99Å; R186-L189 WeakPolarHBondContact O-CB 3.48Å; R186-L189 PolarHBondContact O-N 3.07Å; L189-G191 VanDerWaalsContact C-N 3.33Å; L189-G191 PolarHBondContact O-N 3.01Å; L189-H192 CarbonylContact O-C 3.35Å; L189-H192 WeakPolarHBondContact O-CB 3.29Å; L189-H192 PolarHBondContact O-N 3.14Å; L189-H192 VanDerWaalsContact O-N 3.14Å; L189-L193 HydrophobicContact CD1-CD1 4.33Å; L189-L193 HydrophobicContact CD1-CG 4.11Å; L189-L193 HydrophobicContact CG-CD1 4.09Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 VanDerWaalsContact O-CG 3.31Å; L189-L193 WeakPolarHBondContact O-CG 3.31Å; L189-L193 PolarHBondContact O-N 3.01Å
190	T	79.4	Confident	71.9	Confident	66 Å²	66	73.4 Å²	73.4	41%	0.405	40%	0.399	S	S	.	.	H	α-helix	trans	-60.7	-40.9	176.5	-56	0	0	0	0	112.1	R186 D187 L193 R194	R186-T190 PolarHBondContact O-N 2.7Å; R186-T190 PolarHBondContact O-OG1 3.45Å; R186-T190 VanDerWaalsContact O-OG1 3.07Å; D187-T190 PolarHBondContact O-N 3.15Å; T190-L193 PolarHBondContact O-N 3.48Å; T190-R194 PolarHBondContact O-N 3.05Å
191	G	76.3	Confident	71.4	Confident	39 Å²	39	72 Å²	72	40%	0.402	39%	0.387	S	S	.	.	H	α-helix	trans	-63.9	-41	172.5	0	0	0	0	0	112.8	D187 A188 L189 R194	D187-G191 PolarHBondContact O-N 3.38Å; A188-G191 PolarHBondContact O-N 3.29Å; L189-G191 VanDerWaalsContact C-N 3.33Å; L189-G191 PolarHBondContact O-N 3.01Å; G191-R194 WeakPolarHBondContact O-CB 3.29Å; G191-R194 PolarHBondContact O-N 3.46Å
192	H	79.1	Confident	71.2	Confident	15 Å²	15	70.6 Å²	70.6	7%	0.069	38%	0.384	C	S	.	.	H	α-helix	trans	-67.1	-37.6	176.4	169.2	70.1	0	0	0	113.1	C176 C179 Y181 A188 L189 R194 T195 H196	C176-H192 WeakPolarHBondContact CB-NE2 3.46Å; C176-H192 VanDerWaalsContact SG-CD2 3.58Å; C176-H192 PolarHBondContact SG-NE2 3.36Å; C179-H192 PolarHBondContact SG-NE2 2.97Å; C179-H192 VanDerWaalsContact SG-NE2 3.38Å; Y181-H192 HydrophobicContact CD1-CB 4.12Å; Y181-H192 AromaticContact CD1-CD2 3.37Å; Y181-H192 WeakPolarHBondContact CD1-CD2 3.39Å; Y181-H192 AromaticContact CD1-CE1 3.77Å; Y181-H192 AromaticContact CD1-CG 3.46Å; Y181-H192 VanDerWaalsContact CD1-CG 3.46Å; Y181-H192 AromaticContact CD1-ND1 3.71Å; Y181-H192 AromaticContact CD1-NE2 3.56Å; Y181-H192 HydrophobicContact CE1-CB 3.85Å; Y181-H192 AromaticContact CE1-CG 3.69Å; Y181-H192 AromaticContact CG-CE1 3.7Å; Y181-H192 AromaticContact CG-ND1 3.93Å; Y181-H192 AromaticContact CG-NE2 3.77Å; A188-H192 VanDerWaalsContact O-CB 3.24Å; A188-H192 WeakPolarHBondContact O-CB 3.45Å; A188-H192 PolarHBondContact O-N 3.31Å; L189-H192 CarbonylContact O-C 3.35Å; L189-H192 WeakPolarHBondContact O-CB 3.29Å; L189-H192 PolarHBondContact O-N 3.14Å; L189-H192 VanDerWaalsContact O-N 3.14Å; H192-R194 PolarHBondContact O-N 3.26Å; H192-T195 WeakPolarHBondContact O-CA 3.39Å; H192-T195 WeakPolarHBondContact O-CB 3.32Å; H192-T195 PolarHBondContact O-N 3.38Å; H192-T195 PolarHBondContact O-OG1 2.94Å; H192-H196 AromaticContact CE1-NE2 3.43Å; H192-H196 PolarHBondContact CE1-NE2 3.12Å; H192-H196 AromaticContact NE2-CD2 3.87Å; H192-H196 AromaticContact NE2-NE2 3.19Å; H192-H196 PolarHBondContact NE2-NE2 2.94Å; H192-H196 VanDerWaalsContact NE2-NE2 3.19Å
193	L	73.3	Confident	70.8	Confident	51 Å²	51	75.4 Å²	75.4	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-31.1	175.2	-73.5	169.4	0	0	0	112.3	P177 F178 L189 T190 T195 H196 S197	P177-L193 HydrophobicContact CG-CD2 4.34Å; F178-L193 HydrophobicContact CD2-CD2 3.93Å; F178-L193 HydrophobicContact CE2-CD2 3.99Å; L189-L193 HydrophobicContact CD1-CD1 4.33Å; L189-L193 HydrophobicContact CD1-CG 4.11Å; L189-L193 HydrophobicContact CG-CD1 4.09Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 VanDerWaalsContact O-CG 3.31Å; L189-L193 WeakPolarHBondContact O-CG 3.31Å; L189-L193 PolarHBondContact O-N 3.01Å; T190-L193 PolarHBondContact O-N 3.48Å; L193-T195 PolarHBondContact O-N 3.36Å; L193-T195 VanDerWaalsContact O-N 3.15Å; L193-H196 PolarHBondContact O-N 2.88Å; L193-H196 VanDerWaalsContact O-N 3.07Å; L193-S197 PolarHBondContact O-N 3.4Å; L193-S197 VanDerWaalsContact O-N 3.13Å
194	R	73.3	Confident	70.6	Confident	193 Å²	193	75 Å²	75	73%	0.728	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-2.6	170.3	-59.6	171.7	-176.3	-177.7	-0.7	114.1	T190 G191 H192	T190-R194 PolarHBondContact O-N 3.05Å; G191-R194 WeakPolarHBondContact O-CB 3.29Å; G191-R194 PolarHBondContact O-N 3.46Å; H192-R194 PolarHBondContact O-N 3.26Å
195	T	66.8	Low	70	Confident	50 Å²	50	78.4 Å²	78.4	31%	0.307	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-16.3	169.7	74.5	0	0	0	0	113.2	H192 L193 S210	H192-T195 WeakPolarHBondContact O-CA 3.39Å; H192-T195 WeakPolarHBondContact O-CB 3.32Å; H192-T195 PolarHBondContact O-N 3.38Å; H192-T195 PolarHBondContact O-OG1 2.94Å; L193-T195 PolarHBondContact O-N 3.36Å; L193-T195 VanDerWaalsContact O-N 3.15Å; T195-S210 PolarHBondContact O-N 3.18Å; T195-S210 VanDerWaalsContact O-N 3.12Å
196	H	67.4	Low	69.4	Low	12 Å²	12	82.2 Å²	82.2	6%	0.056	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-45.6	169.7	-65	-78.2	0	0	0	110.8	C176 F178 H192 L193 C207 G208 S210	C176-H196 PolarHBondContact SG-NE2 3.49Å; C176-H196 VanDerWaalsContact SG-NE2 3.39Å; F178-H196 HydrophobicContact CD2-CB 4.1Å; F178-H196 AromaticContact CD2-CG 3.93Å; H192-H196 AromaticContact CE1-NE2 3.43Å; H192-H196 PolarHBondContact CE1-NE2 3.12Å; H192-H196 AromaticContact NE2-CD2 3.87Å; H192-H196 AromaticContact NE2-NE2 3.19Å; H192-H196 PolarHBondContact NE2-NE2 2.94Å; H192-H196 VanDerWaalsContact NE2-NE2 3.19Å; L193-H196 PolarHBondContact O-N 2.88Å; L193-H196 VanDerWaalsContact O-N 3.07Å; H196-C207 PolarHBondContact CE1-O 3.45Å; H196-G208 PolarHBondContact ND1-O 3.23Å; H196-S210 PolarHBondContact O-OG 2.74Å
197	S	65.3	Low	68.8	Low	68 Å²	68	74.6 Å²	74.6	48%	0.476	41%	0.411	S	S	.	.	S	Bend	trans	-86.3	150.7	-176.2	-59.1	0	0	0	0	114.4	L193	L193-S197 PolarHBondContact O-N 3.4Å; L193-S197 VanDerWaalsContact O-N 3.13Å
198	V	55	Low	68.1	Low	130 Å²	130	71.4 Å²	71.4	79%	0.788	40%	0.4	S	S	*	.	S	Bend	trans	77.8	126.2	168.2	-167.8	0	0	0	0	117.9	K200	V198-K200 PolarHBondContact O-N 3.29Å
199	G	54.2	Low	67.4	Low	74 Å²	74	74.5 Å²	74.5	76%	0.763	40%	0.404	S	S	*	.	S	Bend	trans	73	22	147.2	0	0	0	0	0	118.3
200	K	57.3	Low	67	Low	72 Å²	72	73.6 Å²	73.6	31%	0.313	40%	0.401	S	S	.	.			trans	-145.4	115.1	-170	-73	-175.5	-171.4	173.4	0	111.5	V198 S210 Y211 K212	V198-K200 PolarHBondContact O-N 3.29Å; K200-S210 VanDerWaalsContact CD-C 3.43Å; K200-S210 WeakPolarHBondContact CD-O 3.43Å; K200-S210 PolarHBondContact NZ-O 2.94Å; K200-S210 VanDerWaalsContact NZ-O 3.1Å; K200-Y211 WeakPolarHBondContact CB-O 3.46Å; K200-K212 HydrophobicContact CD-CG 4.27Å; K200-K212 HydrophobicContact CG-CG 3.94Å
201	P	63.3	Low	66.5	Low	99 Å²	99	72.3 Å²	72.3	64%	0.643	39%	0.389	S	S	*	.	S	Bend	trans	-77.7	-25.4	-170.8	28.6	-33.5	0	0	0	114	K203	P201-K203 PolarHBondContact O-N 2.93Å
202	H	67	Low	66.2	Low	61 Å²	61	78.4 Å²	78.4	28%	0.282	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	98.7	-173.9	-60.3	-62.2	0	0	0	110.9	Y211 R214 L217	H202-Y211 PolarHBondContact N-O 3.04Å; H202-Y211 WeakPolarHBondContact O-CB 3.36Å; H202-Y211 PolarHBondContact O-N 3.11Å; H202-R214 PolarHBondContact CD2-N 3.47Å; H202-L217 HydrophobicContact CB-CB 4.15Å; H202-L217 HydrophobicContact CB-CD2 3.86Å
203	K	68.1	Low	65.9	Low	127 Å²	127	83.2 Å²	83.2	55%	0.552	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	146.3	176.4	-60	-171.3	178.8	177.1	0	111.4	P201 R209 L217	P201-K203 PolarHBondContact O-N 2.93Å; K203-R209 CarbonylContact C-O 3.58Å; K203-R209 WeakPolarHBondContact CA-O 3.46Å; K203-L217 WeakPolarHBondContact O-CD2 3.46Å
204	C	71.8	Confident	65.8	Low	2 Å²	2	89.3 Å²	89.3	1%	0.014	45%	0.446	C	S	.	.			trans	-87.1	121.1	169.1	-173.4	0	0	0	0	110.8	Y206 C207 G208 R209 L217 H225	C204-Y206 VanDerWaalsContact C-N 3.29Å; C204-Y206 PolarHBondContact O-N 3.13Å; C204-C207 VanDerWaalsContact CB-SG 3.52Å; C204-C207 PolarHBondContact O-N 3.32Å; C204-G208 VanDerWaalsContact O-CA 3.3Å; C204-G208 WeakPolarHBondContact O-CA 3.4Å; C204-G208 PolarHBondContact O-N 2.95Å; C204-R209 PolarHBondContact N-O 3.12Å; C204-L217 HydrophobicContact CB-CD1 3.51Å; C204-H225 PolarHBondContact SG-NE2 3.36Å
205	N	65.3	Low	65.9	Low	158 Å²	158	83.6 Å²	83.6	85%	0.845	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.4	-177.9	-62.6	-3.3	0	0	0	112.9
206	Y	60.3	Low	66.3	Low	183 Å²	183	83.1 Å²	83.1	72%	0.718	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-17.2	-177.2	-58.7	-73.2	0	0	0	114.6	C204 H225	C204-Y206 VanDerWaalsContact C-N 3.29Å; C204-Y206 PolarHBondContact O-N 3.13Å; Y206-H225 VanDerWaalsContact CB-CE1 3.48Å; Y206-H225 WeakPolarHBondContact CB-CE1 3.33Å; Y206-H225 AromaticContact CD2-CD2 3.69Å; Y206-H225 AromaticContact CD2-NE2 3.99Å
207	C	66.4	Low	66.7	Low	19 Å²	19	83.1 Å²	83.1	13%	0.128	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141	7.1	-175	82.8	0	0	0	0	114.5	F178 C179 H196 C204 R209 H220	F178-C207 CarbonylContact O-C 3.58Å; C179-C207 HydrophobicContact CB-CB 4.4Å; C179-C207 VanDerWaalsContact CB-O 3.28Å; C179-C207 WeakPolarHBondContact CB-O 3.25Å; H196-C207 PolarHBondContact CE1-O 3.45Å; C204-C207 VanDerWaalsContact CB-SG 3.52Å; C204-C207 PolarHBondContact O-N 3.32Å; C207-R209 PolarHBondContact O-N 3.31Å; C207-H220 PolarHBondContact SG-NE2 2.84Å
208	G	63.1	Low	67	Low	24 Å²	24	83 Å²	83	25%	0.247	43%	0.427	C	S	.	.			trans	63.1	-3.1	176	0	0	0	0	0	117.1	H196 C204	H196-G208 PolarHBondContact ND1-O 3.23Å; C204-G208 VanDerWaalsContact O-CA 3.3Å; C204-G208 WeakPolarHBondContact O-CA 3.4Å; C204-G208 PolarHBondContact O-N 2.95Å
209	R	62.8	Low	68	Low	97 Å²	97	81 Å²	81	37%	0.366	41%	0.408	S	S	.	.			trans	-69	142.7	-177.5	-80.5	-177.9	165.5	176.6	-3.3	111.9	K203 C204 C207 Y211	K203-R209 CarbonylContact C-O 3.58Å; K203-R209 WeakPolarHBondContact CA-O 3.46Å; C204-R209 PolarHBondContact N-O 3.12Å; C207-R209 PolarHBondContact O-N 3.31Å; R209-Y211 HydrophobicContact CB-CD2 4.45Å; R209-Y211 HydrophobicContact CB-CE2 3.56Å; R209-Y211 WeakPolarHBondContact CD-OH 3.14Å
210	S	70.8	Confident	69	Low	6 Å²	6	78.3 Å²	78.3	4%	0.042	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.5	-178	-57.5	0	0	0	0	112.1	T195 H196 K200	T195-S210 PolarHBondContact O-N 3.18Å; T195-S210 VanDerWaalsContact O-N 3.12Å; H196-S210 PolarHBondContact O-OG 2.74Å; K200-S210 VanDerWaalsContact CD-C 3.43Å; K200-S210 WeakPolarHBondContact CD-O 3.43Å; K200-S210 PolarHBondContact NZ-O 2.94Å; K200-S210 VanDerWaalsContact NZ-O 3.1Å
211	Y	70.9	Confident	69.6	Low	39 Å²	39	77.8 Å²	77.8	15%	0.153	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.8	-173.8	-66.5	-93.2	0	0	0	112.3	K200 H202 R209 S216 L217 H220	K200-Y211 WeakPolarHBondContact CB-O 3.46Å; H202-Y211 PolarHBondContact N-O 3.04Å; H202-Y211 WeakPolarHBondContact O-CB 3.36Å; H202-Y211 PolarHBondContact O-N 3.11Å; R209-Y211 HydrophobicContact CB-CD2 4.45Å; R209-Y211 HydrophobicContact CB-CE2 3.56Å; R209-Y211 WeakPolarHBondContact CD-OH 3.14Å; Y211-S216 VanDerWaalsContact CD1-O 3.32Å; Y211-S216 WeakPolarHBondContact CD1-O 3.06Å; Y211-S216 WeakPolarHBondContact CE1-O 3.03Å; Y211-L217 HydrophobicContact CD2-CB 4.23Å; Y211-L217 HydrophobicContact CD2-CD1 4Å; Y211-L217 HydrophobicContact CE2-CD1 4.3Å; Y211-L217 HydrophobicContact CG-CB 4.25Å; Y211-H220 HydrophobicContact CE1-CB 4.08Å; Y211-H220 HydrophobicContact CE2-CB 4.35Å; Y211-H220 AromaticContact CE2-CD2 3.53Å; Y211-H220 AromaticContact CZ-CD2 3.52Å; Y211-H220 AromaticContact CZ-CG 3.6Å; Y211-H220 PolarHBondContact OH-CD2 2.9Å
212	K	68.6	Low	69.9	Low	166 Å²	166	78.7 Å²	78.7	72%	0.722	37%	0.369	S	S	*	.	S	Bend	trans	-71.2	-31.7	-179.7	-76.6	-169.9	174.7	-171.8	0	112.8	K200	K200-K212 HydrophobicContact CD-CG 4.27Å; K200-K212 HydrophobicContact CG-CG 3.94Å
213	Q	72.3	Confident	69.9	Low	117 Å²	117	83.5 Å²	83.5	55%	0.547	39%	0.385	S	S	.	.	S	Bend	trans	-130.5	152.8	-175.3	-65.5	177.9	-10.6	0	0	110.4	S215 S216 L217	Q213-S215 WeakPolarHBondContact CB-OG 3.44Å; Q213-S215 PolarHBondContact OE1-OG 3.47Å; Q213-S216 PolarHBondContact O-N 3.28Å; Q213-L217 PolarHBondContact O-N 3.44Å
214	R	72.3	Confident	69.7	Low	179 Å²	179	79.9 Å²	79.9	68%	0.675	38%	0.375	S	S	*	.	H	α-helix	trans	-65.8	-37.4	178.6	-167.8	177	-177.1	166.4	1.1	112.1	H202 S216 L217 E218	H202-R214 PolarHBondContact CD2-N 3.47Å; R214-S216 PolarHBondContact O-N 3.13Å; R214-L217 WeakPolarHBondContact O-CB 3.16Å; R214-L217 PolarHBondContact O-N 3.33Å; R214-L217 VanDerWaalsContact O-N 3.13Å; R214-E218 PolarHBondContact O-N 3.31Å
215	S	75.2	Confident	69.5	Low	72 Å²	72	81 Å²	81	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-52.7	-51.5	173.6	45	0	0	0	0	112.5	Q213 L217 E218 E219	Q213-S215 WeakPolarHBondContact CB-OG 3.44Å; Q213-S215 PolarHBondContact OE1-OG 3.47Å; S215-L217 PolarHBondContact O-N 3.46Å; S215-E218 PolarHBondContact O-N 3.1Å; S215-E218 VanDerWaalsContact O-N 3.12Å; S215-E219 WeakPolarHBondContact O-CB 3.34Å; S215-E219 PolarHBondContact O-N 3.09Å
216	S	75.9	Confident	69.1	Low	40 Å²	40	77 Å²	77	28%	0.28	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-21	179.4	-42.4	0	0	0	0	113.9	Y211 Q213 R214 H220	Y211-S216 VanDerWaalsContact CD1-O 3.32Å; Y211-S216 WeakPolarHBondContact CD1-O 3.06Å; Y211-S216 WeakPolarHBondContact CE1-O 3.03Å; Q213-S216 PolarHBondContact O-N 3.28Å; R214-S216 PolarHBondContact O-N 3.13Å; S216-H220 VanDerWaalsContact O-CB 3.29Å; S216-H220 WeakPolarHBondContact O-CB 3.48Å; S216-H220 PolarHBondContact O-N 3.02Å
217	L	76	Confident	68.8	Low	13 Å²	13	76.1 Å²	76.1	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-78.1	-41.6	170.2	170.4	62	0	0	0	110.9	H202 K203 C204 Y211 Q213 R214 S215 H220 K221	H202-L217 HydrophobicContact CB-CB 4.15Å; H202-L217 HydrophobicContact CB-CD2 3.86Å; K203-L217 WeakPolarHBondContact O-CD2 3.46Å; C204-L217 HydrophobicContact CB-CD1 3.51Å; Y211-L217 HydrophobicContact CD2-CB 4.23Å; Y211-L217 HydrophobicContact CD2-CD1 4Å; Y211-L217 HydrophobicContact CE2-CD1 4.3Å; Y211-L217 HydrophobicContact CG-CB 4.25Å; Q213-L217 PolarHBondContact O-N 3.44Å; R214-L217 WeakPolarHBondContact O-CB 3.16Å; R214-L217 PolarHBondContact O-N 3.33Å; R214-L217 VanDerWaalsContact O-N 3.13Å; S215-L217 PolarHBondContact O-N 3.46Å; L217-H220 WeakPolarHBondContact O-CB 3.48Å; L217-H220 PolarHBondContact O-N 3.38Å; L217-K221 WeakPolarHBondContact O-CG 3.49Å; L217-K221 PolarHBondContact O-N 2.83Å
218	E	71.1	Confident	68.2	Low	66 Å²	66	80.5 Å²	80.5	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-68.4	-47.9	-179.7	-135.6	61.8	-141.3	0	0	111.4	R214 S215 H220 K221 E222	R214-E218 PolarHBondContact O-N 3.31Å; S215-E218 PolarHBondContact O-N 3.1Å; S215-E218 VanDerWaalsContact O-N 3.12Å; E218-H220 PolarHBondContact O-N 3.42Å; E218-H220 VanDerWaalsContact O-N 3.15Å; E218-K221 WeakPolarHBondContact O-CA 3.37Å; E218-K221 WeakPolarHBondContact O-CB 3.4Å; E218-K221 PolarHBondContact O-N 3.26Å; E218-K221 WeakPolarHBondContact OE1-CD 3.18Å; E218-K221 WeakPolarHBondContact OE1-CE 3.34Å; E218-K221 IonicContact OE1-NZ 3.37Å; E218-K221 PolarHBondContact OE1-NZ 2.93Å; E218-K221 IonicContact OE2-NZ 2.64Å; E218-K221 PolarHBondContact OE2-NZ 2.98Å; E218-E222 WeakPolarHBondContact O-CG 3.3Å; E218-E222 PolarHBondContact O-N 3.31Å
219	E	74.7	Confident	67.7	Low	87 Å²	87	85.4 Å²	85.4	41%	0.407	39%	0.393	S	S	.	.	H	α-helix	trans	-56.3	-33.8	172.1	-167.1	-155.2	167.2	0	0	112	S215 R223	S215-E219 WeakPolarHBondContact O-CB 3.34Å; S215-E219 PolarHBondContact O-N 3.09Å; E219-R223 VanDerWaalsContact O-CB 3.32Å; E219-R223 WeakPolarHBondContact O-CB 3.28Å; E219-R223 PolarHBondContact O-N 2.82Å; E219-R223 IonicContact OE1-CZ 3.18Å; E219-R223 IonicContact OE1-NH1 2.69Å; E219-R223 PolarHBondContact OE1-NH1 2.79Å; E219-R223 IonicContact OE1-NH2 2.75Å; E219-R223 PolarHBondContact OE1-NH2 2.9Å
220	H	75.3	Confident	67	Low	17 Å²	17	85.4 Å²	85.4	8%	0.079	40%	0.401	C	S	.	.	H	α-helix	trans	-70.1	-42.3	174	169.3	45.9	0	0	0	112.5	C207 Y211 S216 L217 E218 R223 C224	C207-H220 PolarHBondContact SG-NE2 2.84Å; Y211-H220 HydrophobicContact CE1-CB 4.08Å; Y211-H220 HydrophobicContact CE2-CB 4.35Å; Y211-H220 AromaticContact CE2-CD2 3.53Å; Y211-H220 AromaticContact CZ-CD2 3.52Å; Y211-H220 AromaticContact CZ-CG 3.6Å; Y211-H220 PolarHBondContact OH-CD2 2.9Å; S216-H220 VanDerWaalsContact O-CB 3.29Å; S216-H220 WeakPolarHBondContact O-CB 3.48Å; S216-H220 PolarHBondContact O-N 3.02Å; L217-H220 WeakPolarHBondContact O-CB 3.48Å; L217-H220 PolarHBondContact O-N 3.38Å; E218-H220 PolarHBondContact O-N 3.42Å; E218-H220 VanDerWaalsContact O-N 3.15Å; H220-R223 PolarHBondContact O-N 3.46Å; H220-C224 VanDerWaalsContact CE1-CB 3.45Å; H220-C224 WeakPolarHBondContact CE1-CB 3.38Å; H220-C224 VanDerWaalsContact CE1-SG 3.53Å; H220-C224 PolarHBondContact ND1-SG 2.99Å; H220-C224 VanDerWaalsContact O-CB 3.22Å; H220-C224 WeakPolarHBondContact O-CB 3.42Å; H220-C224 PolarHBondContact O-N 3.19Å
221	K	71.4	Confident	66.1	Low	62 Å²	62	88.3 Å²	88.3	27%	0.27	42%	0.418	S	S	.	.	H	α-helix	trans	-62.4	-47	173.7	-67.3	161.6	172.9	172.5	0	110.9	L217 E218 R223 C224 H225 N226	L217-K221 WeakPolarHBondContact O-CG 3.49Å; L217-K221 PolarHBondContact O-N 2.83Å; E218-K221 WeakPolarHBondContact O-CA 3.37Å; E218-K221 WeakPolarHBondContact O-CB 3.4Å; E218-K221 PolarHBondContact O-N 3.26Å; E218-K221 WeakPolarHBondContact OE1-CD 3.18Å; E218-K221 WeakPolarHBondContact OE1-CE 3.34Å; E218-K221 IonicContact OE1-NZ 3.37Å; E218-K221 PolarHBondContact OE1-NZ 2.93Å; E218-K221 IonicContact OE2-NZ 2.64Å; E218-K221 PolarHBondContact OE2-NZ 2.98Å; K221-R223 VanDerWaalsContact C-N 3.29Å; K221-R223 PolarHBondContact O-N 3.34Å; K221-C224 PolarHBondContact O-N 2.84Å; K221-H225 WeakPolarHBondContact O-CA 3.43Å; K221-H225 WeakPolarHBondContact O-CB 3.42Å; K221-H225 PolarHBondContact O-N 3.02Å; K221-N226 PolarHBondContact O-N 3.32Å
222	E	68.6	Low	65	Low	117 Å²	117	90.6 Å²	90.6	55%	0.547	44%	0.439	S	S	.	.	H	α-helix	trans	-58.5	-41.3	179.1	-71	168.6	-179.8	0	0	111.5	E218 N226	E218-E222 WeakPolarHBondContact O-CG 3.3Å; E218-E222 PolarHBondContact O-N 3.31Å; E222-N226 WeakPolarHBondContact O-CB 3.45Å; E222-N226 PolarHBondContact O-ND2 2.88Å
223	R	67.8	Low	64.1	Low	163 Å²	163	89 Å²	89	62%	0.615	44%	0.436	S	S	*	.	H	α-helix	trans	-84.3	-24.2	179.7	-163.5	174.3	-66.9	117.3	-5.8	114.8	E219 H220 K221	E219-R223 VanDerWaalsContact O-CB 3.32Å; E219-R223 WeakPolarHBondContact O-CB 3.28Å; E219-R223 PolarHBondContact O-N 2.82Å; E219-R223 IonicContact OE1-CZ 3.18Å; E219-R223 IonicContact OE1-NH1 2.69Å; E219-R223 PolarHBondContact OE1-NH1 2.79Å; E219-R223 IonicContact OE1-NH2 2.75Å; E219-R223 PolarHBondContact OE1-NH2 2.9Å; H220-R223 PolarHBondContact O-N 3.46Å; K221-R223 VanDerWaalsContact C-N 3.29Å; K221-R223 PolarHBondContact O-N 3.34Å
224	C	62.7	Low	62.6	Low	51 Å²	51	89.9 Å²	89.9	35%	0.345	44%	0.44	S	S	.	.	H	α-helix	trans	-117.5	-12.2	-172.9	-62.2	0	0	0	0	115.7	H220 K221 L228	H220-C224 VanDerWaalsContact CE1-CB 3.45Å; H220-C224 WeakPolarHBondContact CE1-CB 3.38Å; H220-C224 VanDerWaalsContact CE1-SG 3.53Å; H220-C224 PolarHBondContact ND1-SG 2.99Å; H220-C224 VanDerWaalsContact O-CB 3.22Å; H220-C224 WeakPolarHBondContact O-CB 3.42Å; H220-C224 PolarHBondContact O-N 3.19Å; K221-C224 PolarHBondContact O-N 2.84Å; C224-L228 WeakPolarHBondContact O-CD1 3.25Å
225	H	67.3	Low	61.2	Low	25 Å²	25	85 Å²	85	12%	0.116	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-32.9	179.1	-60.5	-43.3	0	0	0	113.1	C204 Y206 K221 Y227 L228 Q229	C204-H225 PolarHBondContact SG-NE2 3.36Å; Y206-H225 VanDerWaalsContact CB-CE1 3.48Å; Y206-H225 WeakPolarHBondContact CB-CE1 3.33Å; Y206-H225 AromaticContact CD2-CD2 3.69Å; Y206-H225 AromaticContact CD2-NE2 3.99Å; K221-H225 WeakPolarHBondContact O-CA 3.43Å; K221-H225 WeakPolarHBondContact O-CB 3.42Å; K221-H225 PolarHBondContact O-N 3.02Å; H225-Y227 PolarHBondContact O-N 3.15Å; H225-L228 PolarHBondContact O-N 3.28Å; H225-Q229 PolarHBondContact O-N 3.38Å
226	N	58.4	Low	59.8	Low	75 Å²	75	84.7 Å²	84.7	40%	0.401	44%	0.44	S	S	.	.	H	α-helix	trans	-59	-38	165.8	-65.9	-17.6	0	0	0	110.9	K221 E222 L228 Q229 N230	K221-N226 PolarHBondContact O-N 3.32Å; E222-N226 WeakPolarHBondContact O-CB 3.45Å; E222-N226 PolarHBondContact O-ND2 2.88Å; N226-L228 PolarHBondContact O-N 3.43Å; N226-Q229 PolarHBondContact O-N 2.83Å; N226-N230 WeakPolarHBondContact O-CB 3.46Å; N226-N230 PolarHBondContact O-N 3.33Å; N226-N230 PolarHBondContact O-OD1 2.88Å
227	Y	52.6	Low	58.3	Low	164 Å²	164	85.4 Å²	85.4	64%	0.643	45%	0.453	S	S	*	.	H	α-helix	trans	-59.3	-34.5	174	-174.1	-100.9	0	0	0	112.9	H225 V231	H225-Y227 PolarHBondContact O-N 3.15Å; Y227-V231 HydrophobicContact CE1-CG2 4.32Å; Y227-V231 VanDerWaalsContact O-CG2 3.26Å; Y227-V231 WeakPolarHBondContact O-CG2 3.44Å; Y227-V231 PolarHBondContact O-N 2.93Å
228	L	53.8	Low	56.6	Low	110 Å²	110	92.8 Å²	92.8	58%	0.576	49%	0.488	S	S	*	.	H	α-helix	trans	-80.3	-32.4	178	-66.9	172.4	0	0	0	112.6	C224 H225 N226 S232	C224-L228 WeakPolarHBondContact O-CD1 3.25Å; H225-L228 PolarHBondContact O-N 3.28Å; N226-L228 PolarHBondContact O-N 3.43Å; L228-S232 PolarHBondContact O-N 3.21Å
229	Q	52.5	Low	55.2	Low	128 Å²	128	95.3 Å²	95.3	60%	0.598	51%	0.507	S	S	*	.	H	α-helix	trans	-71.7	-41.2	172.5	-73.6	-176	-63.8	0	0	112	H225 N226 S232 M233	H225-Q229 PolarHBondContact O-N 3.38Å; N226-Q229 PolarHBondContact O-N 2.83Å; Q229-S232 CarbonylContact O-C 3.57Å; Q229-S232 WeakPolarHBondContact O-CA 3.29Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 2.88Å; Q229-S232 VanDerWaalsContact O-N 3.11Å; Q229-M233 WeakPolarHBondContact O-CG 3.38Å; Q229-M233 PolarHBondContact O-N 2.88Å; Q229-M233 VanDerWaalsContact O-N 3.12Å
230	N	49.3	Very low	53.6	Low	97 Å²	97	99.5 Å²	99.5	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-65.1	-44.8	-179.5	-68.1	6.9	0	0	0	111.6	N226 S232 M233 E234	N226-N230 WeakPolarHBondContact O-CB 3.46Å; N226-N230 PolarHBondContact O-N 3.33Å; N226-N230 PolarHBondContact O-OD1 2.88Å; N230-S232 PolarHBondContact O-N 3.35Å; N230-M233 WeakPolarHBondContact O-CA 3.43Å; N230-M233 PolarHBondContact O-N 2.79Å; N230-E234 PolarHBondContact O-N 3.18Å
231	V	51.8	Low	51.7	Low	67 Å²	67	103.7 Å²	103.7	41%	0.406	56%	0.56	S	S	.	*	H	α-helix	trans	-59.5	-31.4	173.2	169.3	0	0	0	0	111.8	Y227 M233 A235	Y227-V231 HydrophobicContact CE1-CG2 4.32Å; Y227-V231 VanDerWaalsContact O-CG2 3.26Å; Y227-V231 WeakPolarHBondContact O-CG2 3.44Å; Y227-V231 PolarHBondContact O-N 2.93Å; V231-M233 VanDerWaalsContact C-N 3.32Å; V231-A235 PolarHBondContact O-N 3.3Å
232	S	47.8	Very low	49.9	Very low	86 Å²	86	109.6 Å²	109.6	60%	0.601	59%	0.588	S	S	*	*	H	α-helix	trans	-75.8	-15.9	174.4	-166.4	0	0	0	0	114.2	L228 Q229 N230	L228-S232 PolarHBondContact O-N 3.21Å; Q229-S232 CarbonylContact O-C 3.57Å; Q229-S232 WeakPolarHBondContact O-CA 3.29Å; Q229-S232 WeakPolarHBondContact O-CB 3.42Å; Q229-S232 PolarHBondContact O-N 2.88Å; Q229-S232 VanDerWaalsContact O-N 3.11Å; N230-S232 PolarHBondContact O-N 3.35Å
233	M	48.6	Very low	48.1	Very low	133 Å²	133	112.5 Å²	112.5	66%	0.655	60%	0.601	S	S	*	*	H	α-helix	trans	-93.4	-38.1	174.8	-67.1	-110.7	64.3	0	0	111.5	Q229 N230 V231 A235 A236 G237	Q229-M233 WeakPolarHBondContact O-CG 3.38Å; Q229-M233 PolarHBondContact O-N 2.88Å; Q229-M233 VanDerWaalsContact O-N 3.12Å; N230-M233 WeakPolarHBondContact O-CA 3.43Å; N230-M233 PolarHBondContact O-N 2.79Å; V231-M233 VanDerWaalsContact C-N 3.32Å; M233-A235 VanDerWaalsContact C-N 3.28Å; M233-A235 PolarHBondContact O-N 3.45Å; M233-A236 WeakPolarHBondContact O-CB 3.31Å; M233-A236 PolarHBondContact O-N 3.46Å; M233-G237 PolarHBondContact O-N 2.9Å
234	E	40.6	Very low	46.3	Very low	136 Å²	136	110.8 Å²	110.8	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-59.5	-39.9	174.5	-70.9	174	160.8	0	0	111.3	N230 A236 G237	N230-E234 PolarHBondContact O-N 3.18Å; E234-A236 PolarHBondContact O-N 3.39Å; E234-G237 PolarHBondContact O-N 3.18Å
235	A	43.8	Very low	44.8	Very low	76 Å²	76	113 Å²	113	63%	0.628	62%	0.623	S	S	*	*	H	α-helix	trans	-63.7	-20.6	173.3	0	0	0	0	0	114.4	V231 M233	V231-A235 PolarHBondContact O-N 3.3Å; M233-A235 VanDerWaalsContact C-N 3.28Å; M233-A235 PolarHBondContact O-N 3.45Å
236	A	46.1	Very low	43.2	Very low	65 Å²	65	118 Å²	118	54%	0.537	66%	0.658	S	S	.	*	H	α-helix	trans	-94.1	-27	177.7	0	0	0	0	0	113	M233 E234 Q238	M233-A236 WeakPolarHBondContact O-CB 3.31Å; M233-A236 PolarHBondContact O-N 3.46Å; E234-A236 PolarHBondContact O-N 3.39Å; A236-Q238 VanDerWaalsContact C-N 3.28Å; A236-Q238 PolarHBondContact O-N 3.11Å
237	G	43.6	Very low	41.7	Very low	55 Å²	55	122.9 Å²	122.9	57%	0.567	68%	0.68	S	S	*	*	H	α-helix	trans	-71.8	-17.7	-179.7	0	0	0	0	0	114.8	M233 E234 V239	M233-G237 PolarHBondContact O-N 2.9Å; E234-G237 PolarHBondContact O-N 3.18Å; G237-V239 VanDerWaalsContact C-N 3.26Å; G237-V239 PolarHBondContact O-N 3.44Å; G237-V239 VanDerWaalsContact O-N 3.14Å
238	Q	41.9	Very low	40.5	Very low	169 Å²	169	124.2 Å²	124.2	79%	0.79	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	12.5	-164.6	-154.8	141.5	48.5	0	0	115.6	A236	A236-Q238 VanDerWaalsContact C-N 3.28Å; A236-Q238 PolarHBondContact O-N 3.11Å
239	V	40.1	Very low	39.2	Very low	119 Å²	119	126.2 Å²	126.2	72%	0.721	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-14.1	-180	-174.9	0	0	0	0	112.6	G237	G237-V239 VanDerWaalsContact C-N 3.26Å; G237-V239 PolarHBondContact O-N 3.44Å; G237-V239 VanDerWaalsContact O-N 3.14Å
240	M	42.1	Very low	37.8	Very low	175 Å²	175	125 Å²	125	86%	0.862	71%	0.708	S	S	*	*	S	Bend	trans	-105.6	43.5	-168.8	-70.8	-69.1	-71.6	0	0	114.4
241	S	34.9	Very low	36.7	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	72%	0.724	S	S	*	*			trans	-144.7	53.9	174.8	71.9	0	0	0	0	114.3
242	H	34	Very low	35.5	Very low	185 Å²	185	135.3 Å²	135.3	86%	0.856	75%	0.746	S	S	*	*			trans	-95.7	139.3	158.4	-85	-75	0	0	0	111.2
243	H	30.4	Very low	34.4	Very low	178 Å²	178	140.7 Å²	140.7	82%	0.824	76%	0.761	S	S	*	*			trans	-66.6	134	-163.8	-147.4	-58	0	0	0	113.2
244	V	30.2	Very low	33.3	Very low	127 Å²	127	142.6 Å²	142.6	77%	0.77	77%	0.768	S	S	*	*			trans	-111.9	123.8	164.4	178.5	0	0	0	0	108.2
245	P	31.3	Very low	33.1	Very low	98 Å²	98	140.7 Å²	140.7	64%	0.636	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-83.8	157.8	169.7	34	-32.7	0	0	0	111.5
246	P	33.7	Very low	32.3	Very low	131 Å²	131	145 Å²	145	85%	0.851	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-76.8	161.9	-174.9	32.1	-36.4	0	0	0	114.1
247	M	27.3	Very low	31.5	Very low	176 Å²	176	149.7 Å²	149.7	87%	0.867	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-81.3	152	174.5	-66.9	170.7	59.5	0	0	112.9
248	E	26.8	Very low	30.6	Very low	192 Å²	192	154.9 Å²	154.9	90%	0.897	81%	0.806	S	S	*	*			trans	-131.8	162	147.1	-71.7	-165	153.3	0	0	109.1
249	D	26.3	Very low	30	Very low	152 Å²	152	153.1 Å²	153.1	81%	0.813	80%	0.802	S	S	*	*			trans	-75.3	140.9	-164	-63.8	-81.8	0	0	0	116.4
250	C	22.8	Very low	29.5	Very low	104 Å²	104	154.2 Å²	154.2	70%	0.703	80%	0.804	S	S	*	*				-178.3	127.8	114	-98.9	0	0	0	0	116.2
251	K	26.6	Very low	28.9	Very low	196 Å²	196	152.4 Å²	152.4	85%	0.852	80%	0.796	S	S	*	*			trans	71.2	149.2	138.5	-65.3	176.8	-178.9	175.4	0	121.2
252	E	27.3	Very low	28.5	Very low	183 Å²	183	153 Å²	153	86%	0.855	80%	0.801	S	S	*	*			trans	-82.3	138.9	179.9	-53.1	148.6	112.3	0	0	111.6
253	Q	24.4	Very low	28.1	Very low	199 Å²	199	150.7 Å²	150.7	93%	0.93	79%	0.794	S	S	*	*			trans	-170	120.4	136.7	-108.9	162.6	13.6	0	0	112.8
254	E	24.9	Very low	28.1	Very low	173 Å²	173	148.8 Å²	148.8	81%	0.808	79%	0.794	S	S	*	*			trans	-100.4	163	155.7	-80.7	-77.1	169.4	0	0	108.1
255	P	37	Very low	28.3	Very low	96 Å²	96	146.8 Å²	146.8	62%	0.623	78%	0.784	S	S	*	*			cis	-124.5	-173.7	-11.7	41	-27.4	0	0	0	111.8
256	I	26.2	Very low	28.3	Very low	166 Å²	166	151 Å²	151	85%	0.851	79%	0.793	S	S	*	*			trans	-160.6	143	137.1	-104.3	151.3	0	0	0	109.7
257	M	29	Very low	28	Very low	165 Å²	165	153 Å²	153	81%	0.813	79%	0.791	S	S	*	*			trans	-101	141.8	176.3	-59.4	162.6	-76.5	0	0	109.3
258	D	25.6	Very low	28.3	Very low	163 Å²	163	155.3 Å²	155.3	87%	0.872	79%	0.79	S	S	*	*			trans	-155.7	148.2	146.6	-119.3	-33	0	0	0	112.8
259	N	29.4	Very low	29.2	Very low	133 Å²	133	150.2 Å²	150.2	71%	0.711	77%	0.774	S	S	*	*			trans	-103.4	148.8	177.3	-73.6	-75.8	0	0	0	110.2
260	N	29.9	Very low	29.8	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	77%	0.766	S	S	*	*				177.3	106.7	114.6	-90.5	-48.9	0	0	0	114
261	I	28.5	Very low	30.8	Very low	137 Å²	137	146.6 Å²	146.6	70%	0.703	76%	0.762	S	S	*	*				36.2	117.2	124.4	-53.6	169	0	0	0	118.1
262	S	26.5	Very low	31.7	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	75%	0.75	S	S	*	*				-134.5	135.1	122.8	-171.2	0	0	0	0	110.6
263	L	26.6	Very low	32.3	Very low	136 Å²	136	141.6 Å²	141.6	71%	0.712	74%	0.744	S	S	*	*			trans	-77.7	170.4	166.3	-68.4	155.2	0	0	0	108
264	V	30	Very low	33.3	Very low	138 Å²	138	139.9 Å²	139.9	84%	0.836	73%	0.733	S	S	*	*			cis	-147.5	155.9	43.8	175	0	0	0	0	110.7
265	P	34.8	Very low	33.9	Very low	86 Å²	86	137.8 Å²	137.8	56%	0.558	73%	0.727	S	S	*	*			trans	-114.2	-166.8	-164.9	31.5	-12.1	0	0	0	115.4
266	F	29.7	Very low	34.2	Very low	186 Å²	186	138.1 Å²	138.1	82%	0.816	73%	0.727	S	S	*	*			trans	78.8	152.3	179.1	-62.8	-88.9	0	0	0	115.1
267	E	29.4	Very low	34.9	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	72%	0.715	S	S	*	*			cis	-149.9	143.6	17.8	-157.2	161.6	-108	0	0	115
268	R	32.9	Very low	35.4	Very low	225 Å²	225	132.6 Å²	132.6	85%	0.849	71%	0.713	S	S	*	*			trans	-161.1	122.2	159.9	-148.6	179.2	-165.5	176.7	5.6	108.4
269	P	46.3	Very low	36.1	Very low	86 Å²	86	133 Å²	133	56%	0.558	71%	0.712	S	S	*	*				-153.3	50.5	114.8	39.8	-20.9	0	0	0	115	V271 I272	P269-V271 PolarHBondContact O-N 3.04Å; P269-I272 HydrophobicContact CB-CD1 4.38Å; P269-I272 PolarHBondContact O-N 3.46Å
270	A	38.4	Very low	36.7	Very low	80 Å²	80	130 Å²	130	66%	0.661	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	12.2	-179.4	0	0	0	0	0	116.9
271	V	42.8	Very low	37.5	Very low	100 Å²	100	132.1 Å²	132.1	61%	0.606	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-29.7	-177.3	-177	0	0	0	0	112.1	P269	P269-V271 PolarHBondContact O-N 3.04Å
272	I	45.4	Very low	37.8	Very low	116 Å²	116	137.3 Å²	137.3	60%	0.595	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-38.8	-172.6	-60.6	177.8	0	0	0	111.3	P269 K274 L275	P269-I272 HydrophobicContact CB-CD1 4.38Å; P269-I272 PolarHBondContact O-N 3.46Å; I272-K274 VanDerWaalsContact C-N 3.27Å; I272-K274 PolarHBondContact O-N 3.34Å; I272-L275 PolarHBondContact O-N 3.25Å; I272-L275 VanDerWaalsContact O-N 3.13Å
273	E	41.2	Very low	38.1	Very low	157 Å²	157	141.2 Å²	141.2	73%	0.734	73%	0.728	S	S	*	*	H	α-helix	trans	-66	-25.3	-177.5	-167.8	172.3	-143.4	0	0	113.7	L275 T276	E273-L275 VanDerWaalsContact C-N 3.3Å; E273-L275 PolarHBondContact O-N 2.98Å; E273-T276 PolarHBondContact O-OG1 3.36Å
274	K	44.2	Very low	38.4	Very low	164 Å²	164	140.7 Å²	140.7	71%	0.713	74%	0.735	S	S	*	*	H	α-helix	trans	-74.2	-17.9	176.1	-70.1	-175.1	177.3	179.8	0	113.6	I272	I272-K274 VanDerWaalsContact C-N 3.27Å; I272-K274 PolarHBondContact O-N 3.34Å
275	L	38.7	Very low	38.3	Very low	128 Å²	128	139.5 Å²	139.5	67%	0.67	73%	0.733	S	S	*	*	H	α-helix	trans	-83.5	-30.3	179.7	-68.3	168.9	0	0	0	112.7	I272 E273	I272-L275 PolarHBondContact O-N 3.25Å; I272-L275 VanDerWaalsContact O-N 3.13Å; E273-L275 VanDerWaalsContact C-N 3.3Å; E273-L275 PolarHBondContact O-N 2.98Å
276	T	41.9	Very low	38.2	Very low	103 Å²	103	141.1 Å²	141.1	63%	0.632	74%	0.742	S	S	*	*	H	α-helix	trans	-80.3	-28.3	179.1	44.6	0	0	0	0	113.4	E273 N278	E273-T276 PolarHBondContact O-OG1 3.36Å; T276-N278 PolarHBondContact O-N 3.49Å
277	A	42.6	Very low	38.2	Very low	73 Å²	73	138.6 Å²	138.6	60%	0.603	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-63.9	-32.3	-175.4	0	0	0	0	0	114.9
278	N	39	Very low	38.2	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-85.9	-15.6	-172	-78.6	-23.8	0	0	0	114.9	T276 G280	T276-N278 PolarHBondContact O-N 3.49Å; N278-G280 PolarHBondContact O-N 3.32Å
279	M	39.2	Very low	38.2	Very low	171 Å²	171	137.8 Å²	137.8	84%	0.842	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-72.1	-12.3	179.5	-65.2	-61.9	-178.6	0	0	113.6	K281	M279-K281 PolarHBondContact O-N 2.79Å
280	G	42.3	Very low	37.1	Very low	70 Å²	70	142.8 Å²	142.8	72%	0.722	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-78.2	-8	-173.7	0	0	0	0	0	116.7	N278	N278-G280 PolarHBondContact O-N 3.32Å
281	K	46.1	Very low	36.7	Very low	185 Å²	185	144.8 Å²	144.8	80%	0.804	76%	0.764	S	S	*	*	S	Bend	trans	-138.2	72.6	-167.1	-68.4	-176.4	-178.7	173.2	0	115.5	M279	M279-K281 PolarHBondContact O-N 2.79Å
282	R	35.3	Very low	35.9	Very low	247 Å²	247	143.1 Å²	143.1	93%	0.932	77%	0.766	S	S	*	*			trans	178.5	106.9	134.4	-94.9	153.4	-160	-155	5.8	111.3
283	K	33.4	Very low	35.1	Very low	200 Å²	200	145.6 Å²	145.6	87%	0.87	78%	0.776	S	S	*	*			trans	-107.2	151	158.8	-69.9	-178.3	177.1	179.7	0	107.7
284	S	32.1	Very low	34.6	Very low	124 Å²	124	146 Å²	146	87%	0.867	78%	0.775	S	S	*	*			trans	59.5	147.7	-173.4	70	0	0	0	0	114.6
285	S	29.1	Very low	33.9	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	78%	0.78	S	S	*	*			cis	-136.4	-176.3	26.5	57.3	0	0	0	0	114.9
286	T	31.6	Very low	33.3	Very low	121 Å²	121	147.1 Å²	147.1	74%	0.742	79%	0.785	S	S	*	*			trans	-75.2	160.6	-176.8	36.1	0	0	0	0	114.6	Q288	T286-Q288 PolarHBondContact O-N 3.37Å
287	P	29.4	Very low	32.7	Very low	132 Å²	132	153 Å²	153	86%	0.857	80%	0.796	S	S	*	*			trans	-73.3	121.5	178.6	29.7	-34.8	0	0	0	112.1
288	Q	29.2	Very low	31.9	Very low	191 Å²	191	158.3 Å²	158.3	89%	0.893	81%	0.806	S	S	*	*			trans	-104.2	130.5	179.8	-171	166.8	-2.9	0	0	111.8	T286	T286-Q288 PolarHBondContact O-N 3.37Å
289	K	33.7	Very low	31.3	Very low	190 Å²	190	156.6 Å²	156.6	83%	0.826	81%	0.805	S	S	*	*			trans	-85.5	142	168.8	-63.5	175.4	179.1	175.7	0	109.9
290	F	24.5	Very low	31	Very low	190 Å²	190	158.5 Å²	158.5	83%	0.833	80%	0.804	S	S	*	*			trans	180	129.9	132.9	-109.2	-131.1	0	0	0	107.2
291	V	29	Very low	30.6	Very low	123 Å²	123	160.1 Å²	160.1	75%	0.745	80%	0.802	S	S	*	*				71.8	118.1	80.2	175.1	0	0	0	0	114.1
292	G	26.7	Very low	29.8	Very low	64 Å²	64	159.1 Å²	159.1	66%	0.66	81%	0.806	S	S	*	*			trans	73.1	121.9	135	0	0	0	0	0	120.2
293	E	28.2	Very low	29.5	Very low	168 Å²	168	153.9 Å²	153.9	79%	0.785	79%	0.794	S	S	*	*			trans	63.6	166.3	168.6	-55.9	-153.8	120.9	0	0	115.2
294	K	30.7	Very low	29.3	Very low	165 Å²	165	153 Å²	153	72%	0.717	79%	0.793	S	S	*	*			cis	-140.9	162	5.7	-150.1	159.7	-166.4	120.6	0	111.9
295	L	29.7	Very low	29.2	Very low	157 Å²	157	156.1 Å²	156.1	82%	0.822	79%	0.791	S	S	*	*			trans	-63.7	132	178.5	-170.5	76.4	0	0	0	111.8
296	M	26.3	Very low	29.1	Very low	159 Å²	159	158.2 Å²	158.2	78%	0.783	79%	0.794	S	S	*	*			trans	-132.7	130.4	165.7	-90.7	-62.6	-145.8	0	0	111.3	F298	M296-F298 HydrophobicContact CB-CE2 4.5Å
297	R	28.7	Very low	29.4	Very low	228 Å²	228	159.7 Å²	159.7	86%	0.86	79%	0.794	S	S	*	*			trans	-83.4	137.2	169.9	-69.4	174.2	172.7	148.4	-4.5	108.8
298	F	26.3	Very low	30.1	Very low	184 Å²	184	160 Å²	160	81%	0.807	79%	0.789	S	S	*	*			trans	-115.6	99.3	163.4	-83.6	-82.9	0	0	0	109.9	M296	M296-F298 HydrophobicContact CB-CE2 4.5Å
299	S	26	Very low	30.3	Very low	106 Å²	106	159.4 Å²	159.4	74%	0.741	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.7	133	154.9	44.3	0	0	0	0	108.7
300	Y	31.6	Very low	30.3	Very low	212 Å²	212	155.5 Å²	155.5	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-74.4	135.8	170.5	-89.8	-106.5	0	0	0	109.8
301	P	34.3	Very low	31	Very low	104 Å²	104	156 Å²	156	68%	0.675	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-74.5	154.2	163	-7.3	24.8	0	0	0	110.7
302	D	30	Very low	31.4	Very low	164 Å²	164	158 Å²	158	88%	0.877	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.2	133.8	172.9	-58.4	-78.1	0	0	0	111.6
303	I	29.5	Very low	32	Very low	136 Å²	136	162.7 Å²	162.7	70%	0.697	78%	0.784	S	S	*	*			trans	-101.7	108.5	174.1	-61.3	177.5	0	0	0	107.9	F305	I303-F305 PolarHBondContact O-N 2.78Å
304	H	28.8	Very low	32.4	Very low	183 Å²	183	161.1 Å²	161.1	85%	0.847	78%	0.777	S	S	*	*			trans	-62.3	122	166.8	-115	-98	0	0	0	109.3	D306	H304-D306 PolarHBondContact O-N 2.96Å
305	F	29.3	Very low	32.9	Very low	189 Å²	189	155.9 Å²	155.9	83%	0.829	76%	0.764	S	S	*	*			trans	-84.5	107.4	165.2	-93.2	-98.4	0	0	0	108.5	I303	I303-F305 PolarHBondContact O-N 2.78Å
306	D	28.6	Very low	33.4	Very low	156 Å²	156	155 Å²	155	83%	0.834	76%	0.755	S	S	*	*			trans	-89.8	127.5	167.4	-159.1	-10.6	0	0	0	108.9	H304	H304-D306 PolarHBondContact O-N 2.96Å
307	M	37.9	Very low	34.1	Very low	152 Å²	152	153.4 Å²	153.4	75%	0.749	75%	0.749	S	S	*	*			trans	-115.6	68.2	-162.9	-153.9	-94.3	95.4	0	0	110.8
308	N	42.5	Very low	34.6	Very low	140 Å²	140	149 Å²	149	75%	0.749	74%	0.74	S	S	*	*			trans	-169.4	98.3	161	-97.2	-44.3	0	0	0	112
309	L	33.1	Very low	35.3	Very low	178 Å²	178	147.2 Å²	147.2	93%	0.932	73%	0.734	S	S	*	*			trans	-152.8	156	155	-134.4	74.1	0	0	0	109.8
310	T	35.3	Very low	36	Very low	107 Å²	107	144.8 Å²	144.8	66%	0.656	72%	0.718	S	S	*	*			trans	-84.2	136.5	-163.1	45.3	0	0	0	0	115	E312	T310-E312 PolarHBondContact O-N 2.75Å
311	Y	38.3	Very low	36.5	Very low	201 Å²	201	140.4 Å²	140.4	79%	0.788	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-13.9	-166.5	-165.6	-112.3	0	0	0	116.5
312	E	37.4	Very low	37	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	70%	0.697	S	S	*	*	H	α-helix	trans	-83.6	-29.3	-171.9	-63.4	179.6	144.1	0	0	113.4	T310	T310-E312 PolarHBondContact O-N 2.75Å
313	K	39.8	Very low	37.5	Very low	164 Å²	164	138.8 Å²	138.8	71%	0.713	69%	0.685	S	S	*	*	H	α-helix	trans	-79.1	-23.2	-177.5	-84	-175.7	173.3	177.7	0	114.7	A315 L317	K313-A315 VanDerWaalsContact C-N 3.33Å; K313-L317 PolarHBondContact O-N 3.42Å
314	E	37	Very low	38.2	Very low	135 Å²	135	136.9 Å²	136.9	63%	0.631	68%	0.677	S	S	*	*	H	α-helix	trans	-71.3	-30.7	177.3	-64.2	-164.6	131.2	0	0	111.9	L317 M318	E314-L317 PolarHBondContact O-N 3.05Å; E314-M318 WeakPolarHBondContact O-CB 3.5Å; E314-M318 PolarHBondContact O-N 3.15Å
315	A	40.6	Very low	39.1	Very low	54 Å²	54	132.4 Å²	132.4	45%	0.446	66%	0.656	S	S	.	*	H	α-helix	trans	-63.7	-46.2	179.8	0	0	0	0	0	112.6	K313 M318 Q319	K313-A315 VanDerWaalsContact C-N 3.33Å; A315-M318 PolarHBondContact O-N 2.99Å; A315-Q319 WeakPolarHBondContact O-CB 3.49Å; A315-Q319 WeakPolarHBondContact O-CG 3.47Å; A315-Q319 PolarHBondContact O-N 3.35Å
316	E	40.2	Very low	39.8	Very low	138 Å²	138	125.9 Å²	125.9	65%	0.645	64%	0.637	S	S	*	*	H	α-helix	trans	-66.1	-37.7	177	-60.5	-170.4	137.1	0	0	112	Q319 S320	E316-Q319 PolarHBondContact O-N 3.47Å; E316-S320 PolarHBondContact O-N 3.34Å; E316-S320 PolarHBondContact O-OG 3.14Å
317	L	41.7	Very low	40.7	Very low	126 Å²	126	122.4 Å²	122.4	66%	0.66	62%	0.618	S	S	*	*	H	α-helix	trans	-69.8	-38.9	177.7	-168.6	63.5	0	0	0	111.7	K313 E314 S320 H321	K313-L317 PolarHBondContact O-N 3.42Å; E314-L317 PolarHBondContact O-N 3.05Å; L317-S320 PolarHBondContact O-OG 3.36Å; L317-H321 WeakPolarHBondContact O-CB 3.27Å; L317-H321 PolarHBondContact O-N 2.96Å; L317-H321 VanDerWaalsContact O-N 3.09Å
318	M	37.6	Very low	41.2	Very low	135 Å²	135	119.8 Å²	119.8	67%	0.665	61%	0.607	S	S	*	*	H	α-helix	trans	-65	-42.6	170.8	-99.3	178.5	45.9	0	0	112.3	E314 A315 M322	E314-M318 WeakPolarHBondContact O-CB 3.5Å; E314-M318 PolarHBondContact O-N 3.15Å; A315-M318 PolarHBondContact O-N 2.99Å; M318-M322 WeakPolarHBondContact O-CB 3.47Å; M318-M322 WeakPolarHBondContact O-CG 3.45Å; M318-M322 PolarHBondContact O-N 3.44Å
319	Q	41.4	Very low	41.4	Very low	147 Å²	147	117.3 Å²	117.3	69%	0.687	59%	0.594	S	S	*	*	H	α-helix	trans	-64.2	-44.6	178.7	-80.7	-174	-30.9	0	0	112.3	A315 E316 M322 M323	A315-Q319 WeakPolarHBondContact O-CB 3.49Å; A315-Q319 WeakPolarHBondContact O-CG 3.47Å; A315-Q319 PolarHBondContact O-N 3.35Å; E316-Q319 PolarHBondContact O-N 3.47Å; Q319-M322 PolarHBondContact O-N 3.04Å; Q319-M323 WeakPolarHBondContact O-CB 3.39Å; Q319-M323 PolarHBondContact O-N 3.33Å
320	S	41.3	Very low	41.8	Very low	56 Å²	56	111 Å²	111	39%	0.392	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-47.7	176.1	52.4	0	0	0	0	112.1	E316 L317 M322 M323 D324	E316-S320 PolarHBondContact O-N 3.34Å; E316-S320 PolarHBondContact O-OG 3.14Å; L317-S320 PolarHBondContact O-OG 3.36Å; S320-M322 VanDerWaalsContact C-N 3.32Å; S320-M322 PolarHBondContact O-N 2.94Å; S320-M323 PolarHBondContact O-N 3.04Å; S320-M323 VanDerWaalsContact O-N 3.12Å; S320-D324 PolarHBondContact O-N 3.41Å
321	H	43	Very low	42.3	Very low	120 Å²	120	109.6 Å²	109.6	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-60.6	-37.8	176.3	-173.2	-72.3	0	0	0	112.7	L317 Q325	L317-H321 WeakPolarHBondContact O-CB 3.27Å; L317-H321 PolarHBondContact O-N 2.96Å; L317-H321 VanDerWaalsContact O-N 3.09Å; H321-Q325 VanDerWaalsContact O-CB 3.24Å; H321-Q325 WeakPolarHBondContact O-CB 3.47Å; H321-Q325 PolarHBondContact O-N 3.39Å
322	M	43.3	Very low	42.8	Very low	107 Å²	107	105.5 Å²	105.5	53%	0.527	55%	0.551	S	S	.	*	H	α-helix	trans	-68.2	-36.4	175.5	-69.8	-90.4	70.7	0	0	112.3	M318 Q319 S320 Q325 A326	M318-M322 WeakPolarHBondContact O-CB 3.47Å; M318-M322 WeakPolarHBondContact O-CG 3.45Å; M318-M322 PolarHBondContact O-N 3.44Å; Q319-M322 PolarHBondContact O-N 3.04Å; S320-M322 VanDerWaalsContact C-N 3.32Å; S320-M322 PolarHBondContact O-N 2.94Å; M322-Q325 PolarHBondContact O-N 3.49Å; M322-A326 WeakPolarHBondContact O-CB 3.49Å; M322-A326 PolarHBondContact O-N 3.02Å
323	M	41.9	Very low	43	Very low	127 Å²	127	107.6 Å²	107.6	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-69.5	-46.2	177.8	-154.1	70.2	-176.7	0	0	111.7	Q319 S320 Q325 A326 I327	Q319-M323 WeakPolarHBondContact O-CB 3.39Å; Q319-M323 PolarHBondContact O-N 3.33Å; S320-M323 PolarHBondContact O-N 3.04Å; S320-M323 VanDerWaalsContact O-N 3.12Å; M323-Q325 VanDerWaalsContact C-N 3.3Å; M323-Q325 PolarHBondContact O-N 3.08Å; M323-A326 WeakPolarHBondContact O-CB 3.38Å; M323-A326 PolarHBondContact O-N 3.12Å; M323-I327 HydrophobicContact CG-CD1 4.44Å; M323-I327 WeakPolarHBondContact O-CG1 3.24Å; M323-I327 PolarHBondContact O-N 3.33Å
324	D	43.3	Very low	43.2	Very low	96 Å²	96	105.1 Å²	105.1	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-61.4	-39.5	174.3	-77.4	-27.3	0	0	0	111.3	S320 I327 N328	S320-D324 PolarHBondContact O-N 3.41Å; D324-I327 PolarHBondContact O-N 3.01Å; D324-N328 WeakPolarHBondContact O-CB 3.32Å; D324-N328 PolarHBondContact O-N 3.3Å; D324-N328 PolarHBondContact O-ND2 3.23Å
325	Q	48.6	Very low	43.4	Very low	88 Å²	88	100.3 Å²	100.3	41%	0.411	53%	0.534	S	S	.	.	H	α-helix	trans	-66.6	-36.1	176.1	-167.4	165	34.2	0	0	112.2	H321 M322 M323 N329	H321-Q325 VanDerWaalsContact O-CB 3.24Å; H321-Q325 WeakPolarHBondContact O-CB 3.47Å; H321-Q325 PolarHBondContact O-N 3.39Å; M322-Q325 PolarHBondContact O-N 3.49Å; M323-Q325 VanDerWaalsContact C-N 3.3Å; M323-Q325 PolarHBondContact O-N 3.08Å; Q325-N329 WeakPolarHBondContact O-CB 2.99Å; Q325-N329 PolarHBondContact O-N 3.46Å; Q325-N329 PolarHBondContact O-ND2 3.27Å; Q325-N329 VanDerWaalsContact O-ND2 3.08Å
326	A	43.7	Very low	43.7	Very low	53 Å²	53	101.5 Å²	101.5	44%	0.438	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-42.6	172.9	0	0	0	0	0	112.3	M322 M323 N329 A330	M322-A326 WeakPolarHBondContact O-CB 3.49Å; M322-A326 PolarHBondContact O-N 3.02Å; M323-A326 WeakPolarHBondContact O-CB 3.38Å; M323-A326 PolarHBondContact O-N 3.12Å; A326-N329 PolarHBondContact O-N 3.22Å; A326-A330 WeakPolarHBondContact O-CB 3.42Å; A326-A330 PolarHBondContact O-N 3.4Å
327	I	47.3	Very low	43.9	Very low	83 Å²	83	103.7 Å²	103.7	43%	0.426	55%	0.554	S	S	.	*	H	α-helix	trans	-64.5	-47.1	177.8	-67.8	163.6	0	0	0	111	M323 D324 N329 A330 I331	M323-I327 HydrophobicContact CG-CD1 4.44Å; M323-I327 WeakPolarHBondContact O-CG1 3.24Å; M323-I327 PolarHBondContact O-N 3.33Å; D324-I327 PolarHBondContact O-N 3.01Å; I327-N329 VanDerWaalsContact C-N 3.31Å; I327-N329 PolarHBondContact O-N 3.19Å; I327-A330 PolarHBondContact O-N 3.43Å; I327-A330 VanDerWaalsContact O-N 3.16Å; I327-I331 HydrophobicContact CG2-CD1 3.91Å; I327-I331 WeakPolarHBondContact O-CG1 3.42Å; I327-I331 PolarHBondContact O-N 3.24Å
328	N	47.5	Very low	44	Very low	96 Å²	96	100.4 Å²	100.4	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-62.6	-37.4	176.7	-77.9	-75.8	0	0	0	112.1	D324 T332	D324-N328 WeakPolarHBondContact O-CB 3.32Å; D324-N328 PolarHBondContact O-N 3.3Å; D324-N328 PolarHBondContact O-ND2 3.23Å; N328-T332 WeakPolarHBondContact O-CB 3.48Å; N328-T332 PolarHBondContact O-N 2.72Å; N328-T332 VanDerWaalsContact O-N 3.07Å; N328-T332 PolarHBondContact O-OG1 2.88Å
329	N	47.3	Very low	44.1	Very low	89 Å²	89	97.5 Å²	97.5	48%	0.476	53%	0.532	S	S	.	.	H	α-helix	trans	-65	-41.1	173.2	-73.8	-26.2	0	0	0	112	Q325 A326 I327 T332 Y333	Q325-N329 WeakPolarHBondContact O-CB 2.99Å; Q325-N329 PolarHBondContact O-N 3.46Å; Q325-N329 PolarHBondContact O-ND2 3.27Å; Q325-N329 VanDerWaalsContact O-ND2 3.08Å; A326-N329 PolarHBondContact O-N 3.22Å; I327-N329 VanDerWaalsContact C-N 3.31Å; I327-N329 PolarHBondContact O-N 3.19Å; N329-T332 PolarHBondContact O-N 3.46Å; N329-Y333 PolarHBondContact O-N 3.5Å
330	A	41.5	Very low	44	Very low	46 Å²	46	97.9 Å²	97.9	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-44.9	178.4	0	0	0	0	0	112.4	A326 I327 T332 Y333 L334	A326-A330 WeakPolarHBondContact O-CB 3.42Å; A326-A330 PolarHBondContact O-N 3.4Å; I327-A330 PolarHBondContact O-N 3.43Å; I327-A330 VanDerWaalsContact O-N 3.16Å; A330-T332 VanDerWaalsContact C-N 3.26Å; A330-T332 PolarHBondContact O-N 2.94Å; A330-Y333 PolarHBondContact O-N 2.66Å; A330-Y333 VanDerWaalsContact O-N 3.14Å; A330-L334 PolarHBondContact O-N 2.85Å
331	I	46.4	Very low	43.8	Very low	76 Å²	76	100.3 Å²	100.3	39%	0.39	55%	0.548	S	S	.	.	H	α-helix	trans	-58.9	-40.8	174	-66.1	165.5	0	0	0	110.6	I327 Y333 G335 L339	I327-I331 HydrophobicContact CG2-CD1 3.91Å; I327-I331 WeakPolarHBondContact O-CG1 3.42Å; I327-I331 PolarHBondContact O-N 3.24Å; I331-Y333 VanDerWaalsContact C-N 3.32Å; I331-Y333 PolarHBondContact O-N 2.83Å; I331-G335 PolarHBondContact O-N 3.12Å; I331-L339 HydrophobicContact CG1-CD1 4.43Å
332	T	48.9	Very low	43.4	Very low	115 Å²	115	101.4 Å²	101.4	71%	0.706	56%	0.557	S	S	*	*	H	α-helix	trans	-67.4	-29.2	177.7	-55	0	0	0	0	113.2	N328 N329 A330	N328-T332 WeakPolarHBondContact O-CB 3.48Å; N328-T332 PolarHBondContact O-N 2.72Å; N328-T332 VanDerWaalsContact O-N 3.07Å; N328-T332 PolarHBondContact O-OG1 2.88Å; N329-T332 PolarHBondContact O-N 3.46Å; A330-T332 VanDerWaalsContact C-N 3.26Å; A330-T332 PolarHBondContact O-N 2.94Å
333	Y	40.8	Very low	43.3	Very low	208 Å²	208	103.9 Å²	103.9	82%	0.816	57%	0.569	S	S	*	*	H	α-helix	trans	-90.1	-27.4	-178.2	-102	-89.3	0	0	0	114.8	N329 A330 I331	N329-Y333 PolarHBondContact O-N 3.5Å; A330-Y333 PolarHBondContact O-N 2.66Å; A330-Y333 VanDerWaalsContact O-N 3.14Å; I331-Y333 VanDerWaalsContact C-N 3.32Å; I331-Y333 PolarHBondContact O-N 2.83Å
334	L	44.2	Very low	43	Very low	112 Å²	112	106.7 Å²	106.7	59%	0.586	58%	0.581	S	S	*	*	H	α-helix	trans	-109.4	-22.9	-173.7	-66.1	171.6	0	0	0	113.9	A330 A338	A330-L334 PolarHBondContact O-N 2.85Å; L334-A338 HydrophobicContact CB-CB 4.3Å; L334-A338 WeakPolarHBondContact O-CB 3.48Å
335	G	41.7	Very low	42.6	Very low	35 Å²	35	111.2 Å²	111.2	36%	0.361	60%	0.598	S	S	.	*			trans	77.2	148.6	-170.8	0	0	0	0	0	112.6	I331 E337 A338	I331-G335 PolarHBondContact O-N 3.12Å; G335-E337 VanDerWaalsContact C-N 3.27Å; G335-E337 PolarHBondContact O-N 3.1Å; G335-A338 PolarHBondContact O-N 2.83Å
336	A	46.3	Very low	41.7	Very low	79 Å²	79	111.3 Å²	111.3	65%	0.653	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-64	-29.7	-172.8	0	0	0	0	0	113.7	A338	A336-A338 VanDerWaalsContact C-N 3.33Å; A336-A338 PolarHBondContact O-N 3.32Å
337	E	45	Very low	41.1	Very low	183 Å²	183	115 Å²	115	86%	0.855	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-70.3	-28.3	-177.7	-62.8	174.5	161.5	0	0	112.5	G335 L339 H340	G335-E337 VanDerWaalsContact C-N 3.27Å; G335-E337 PolarHBondContact O-N 3.1Å; E337-L339 PolarHBondContact O-N 3.26Å; E337-H340 PolarHBondContact O-N 2.86Å
338	A	43.3	Very low	40.3	Very low	57 Å²	57	116 Å²	116	47%	0.471	65%	0.648	S	S	.	*	G	3₁₀ helix	trans	-71.5	-13.5	-178.3	0	0	0	0	0	114.3	L334 G335 A336	L334-A338 HydrophobicContact CB-CB 4.3Å; L334-A338 WeakPolarHBondContact O-CB 3.48Å; G335-A338 PolarHBondContact O-N 2.83Å; A336-A338 VanDerWaalsContact C-N 3.33Å; A336-A338 PolarHBondContact O-N 3.32Å
339	L	39.1	Very low	39.5	Very low	74 Å²	74	118 Å²	118	39%	0.387	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-94.2	-10.9	-179.3	-68.3	170	0	0	0	113.6	I331 E337 L342	I331-L339 HydrophobicContact CG1-CD1 4.43Å; E337-L339 PolarHBondContact O-N 3.26Å; L339-L342 HydrophobicContact CD2-CD1 4.47Å; L339-L342 PolarHBondContact O-N 3.32Å
340	H	40.1	Very low	38.8	Very low	156 Å²	156	122.4 Å²	122.4	72%	0.722	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-63	-26	-175.7	-151.4	-66.7	0	0	0	116.1	E337 L342	E337-H340 PolarHBondContact O-N 2.86Å; H340-L342 VanDerWaalsContact C-N 3.29Å; H340-L342 PolarHBondContact O-N 3.38Å
341	P	37.5	Very low	38.5	Very low	107 Å²	107	124 Å²	124	70%	0.695	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-70.3	-15.3	177.1	-23.5	35.7	0	0	0	115.7	M343	P341-M343 VanDerWaalsContact C-N 3.33Å; P341-M343 PolarHBondContact O-N 2.95Å
342	L	33.5	Very low	37.8	Very low	143 Å²	143	129.5 Å²	129.5	75%	0.749	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-90	18.9	-168.9	-63.6	175.6	0	0	0	114.7	L339 H340	L339-L342 HydrophobicContact CD2-CD1 4.47Å; L339-L342 PolarHBondContact O-N 3.32Å; H340-L342 VanDerWaalsContact C-N 3.29Å; H340-L342 PolarHBondContact O-N 3.38Å
343	M	40.5	Very low	36.9	Very low	159 Å²	159	130.9 Å²	130.9	78%	0.783	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-126.2	15.1	-170.1	-78.1	-160.7	68.5	0	0	116.1	P341	P341-M343 VanDerWaalsContact C-N 3.33Å; P341-M343 PolarHBondContact O-N 2.95Å
344	Q	36.7	Very low	36.3	Very low	185 Å²	185	125.2 Å²	125.2	86%	0.864	73%	0.727	S	S	*	*	S	Bend	trans	-129.5	152.9	174.7	-65.3	-170.4	-5.1	0	0	112.2
345	H	34	Very low	36.3	Very low	191 Å²	191	124.9 Å²	124.9	88%	0.884	73%	0.732	S	S	*	*			trans	-93.6	175.2	-150.2	-79.4	-87	0	0	0	116.1
346	A	30	Very low	35.7	Very low	90 Å²	90	130.3 Å²	130.3	74%	0.744	76%	0.758	S	S	*	*			trans	-63.2	155.2	-172.4	0	0	0	0	0	115.1
347	P	30.8	Very low	34.7	Very low	131 Å²	131	133.2 Å²	133.2	85%	0.851	76%	0.761	S	S	*	*			trans	-74.3	148.7	178.6	31.4	-36.2	0	0	0	113
348	S	31.2	Very low	33.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	76%	0.759	S	S	*	*			trans	-110.1	139.3	170.9	56.4	0	0	0	0	111.6
349	T	30.6	Very low	33.2	Very low	140 Å²	140	133.4 Å²	133.4	86%	0.859	78%	0.779	S	S	*	*			trans	65.4	143	173.3	55.8	0	0	0	0	117.8
350	I	32.8	Very low	32.8	Very low	181 Å²	181	133.8 Å²	133.8	93%	0.928	79%	0.792	S	S	*	*			trans	-110.8	96	173.9	-61.7	173.7	0	0	0	107.9
351	A	35.3	Very low	32.3	Very low	79 Å²	79	137.2 Å²	137.2	65%	0.653	80%	0.801	S	S	*	*			trans	-164.6	123.9	163.7	0	0	0	0	0	107
352	E	32.7	Very low	31.9	Very low	192 Å²	192	137.1 Å²	137.1	90%	0.897	80%	0.802	S	S	*	*			trans	64.6	129.2	-170.5	-50.6	174.4	-165.4	0	0	111.8
353	V	29.5	Very low	31.8	Very low	143 Å²	143	138.3 Å²	138.3	87%	0.867	80%	0.804	S	S	*	*			cis	-138.5	147.8	23.1	174.1	0	0	0	0	110.8
354	A	28.5	Very low	31.3	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	80%	0.803	S	S	*	*			trans	-152.2	158.3	161.4	0	0	0	0	0	110.2
355	P	43.7	Very low	30.8	Very low	104 Å²	104	138.1 Å²	138.1	68%	0.675	80%	0.802	S	S	*	*			cis	-125.5	160.6	-14.9	38.8	-25.1	0	0	0	113.7
356	V	28.6	Very low	30.6	Very low	150 Å²	150	138.2 Å²	138.2	91%	0.909	80%	0.803	S	S	*	*			trans	-135.7	126.7	154.1	-178.3	0	0	0	0	108.1
357	I	26.1	Very low	30.9	Very low	140 Å²	140	138.5 Å²	138.5	72%	0.718	80%	0.797	S	S	*	*			trans	-113	137.2	-170.5	-68.6	171.8	0	0	0	110.5
358	S	26.4	Very low	30.8	Very low	116 Å²	116	139.8 Å²	139.8	81%	0.811	80%	0.797	S	S	*	*			trans	45.7	95.7	161.4	-60.2	0	0	0	0	119.2
359	S	30.8	Very low	30.6	Very low	127 Å²	127	145.2 Å²	145.2	89%	0.888	80%	0.801	S	S	*	*			trans	-159.2	78	151.5	-166.3	0	0	0	0	114
360	A	30.8	Very low	30.4	Very low	82 Å²	82	144.2 Å²	144.2	68%	0.678	79%	0.789	S	S	*	*	S	Bend	trans	-167.2	141.5	155	0	0	0	0	0	110.7
361	Y	28.3	Very low	30	Very low	228 Å²	228	144.4 Å²	144.4	89%	0.894	79%	0.786	S	S	*	*			trans	56.9	49.9	169.1	-70.3	-77.5	0	0	0	118.7
362	S	28.7	Very low	30.1	Very low	105 Å²	105	151.8 Å²	151.8	73%	0.734	80%	0.797	S	S	*	*			trans	-118.1	61.2	156.7	53.3	0	0	0	0	112
363	Q	31.3	Very low	29.8	Very low	169 Å²	169	148.6 Å²	148.6	79%	0.79	79%	0.794	S	S	*	*			trans	-167.5	131.3	167.1	-95.1	137.1	93.2	0	0	104.8
364	V	30.6	Very low	29.5	Very low	126 Å²	126	149 Å²	149	76%	0.764	79%	0.789	S	S	*	*	S	Bend	cis	-129.4	164.3	30.8	178.5	0	0	0	0	111
365	Y	26.9	Very low	29.5	Very low	213 Å²	213	148.6 Å²	148.6	84%	0.835	78%	0.781	S	S	*	*			trans	82	87.8	-178.5	-65.8	-81.2	0	0	0	116.9
366	H	29.3	Very low	28.8	Very low	194 Å²	194	155.2 Å²	155.2	90%	0.898	79%	0.793	S	S	*	*				-146.6	157.5	119.4	-101.5	-77.6	0	0	0	109.2
367	P	36.3	Very low	28.8	Very low	96 Å²	96	156.1 Å²	156.1	62%	0.623	79%	0.787	S	S	*	*			trans	-102.3	156	-160.2	37.6	-35.2	0	0	0	116.2
368	N	28.6	Very low	28.9	Very low	158 Å²	158	155.5 Å²	155.5	85%	0.845	79%	0.79	S	S	*	*			trans	67.3	135.3	169.8	-53.3	-38.5	0	0	0	114.9
369	R	26.3	Very low	29.2	Very low	216 Å²	216	154.6 Å²	154.6	82%	0.815	78%	0.783	S	S	*	*				-178.2	132.9	64.9	-179	176.5	-173.4	-176	2.1	112.6
370	I	26.6	Very low	29	Very low	119 Å²	119	155.9 Å²	155.9	61%	0.61	78%	0.78	S	S	*	*			trans	75.2	141.1	151.2	-72.7	174.4	0	0	0	121.4
371	E	25.6	Very low	29	Very low	185 Å²	185	156.7 Å²	156.7	86%	0.864	78%	0.781	S	S	*	*			trans	67.4	150.1	160.4	-83.3	146	-137	0	0	124.2
372	R	35.9	Very low	29.3	Very low	234 Å²	234	153.9 Å²	153.9	88%	0.883	78%	0.776	S	S	*	*			trans	-120.6	152.9	175.1	-66.4	173	170.4	171.9	-5.3	108.3
373	P	26.6	Very low	29.4	Very low	126 Å²	126	156.5 Å²	156.5	82%	0.818	78%	0.776	S	S	*	*			trans	-139.1	111.8	134.5	27.9	-10	0	0	0	114.7
374	I	24	Very low	29.4	Very low	151 Å²	151	153.9 Å²	153.9	77%	0.774	77%	0.768	S	S	*	*				29.6	108.2	122.7	-63.6	176.9	0	0	0	118.7
375	S	27.8	Very low	29.4	Very low	82 Å²	82	154.6 Å²	154.6	57%	0.573	77%	0.767	S	S	*	*			trans	39.7	137.2	139.9	66.2	0	0	0	0	125
376	R	28.7	Very low	29.6	Very low	243 Å²	243	152 Å²	152	92%	0.917	77%	0.765	S	S	*	*				-118.4	133.2	116.8	-80.9	174.8	157.4	144.7	-6.8	106.4
377	E	28.7	Very low	29.7	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	76%	0.762	S	S	*	*			cis	75.4	122.1	37.8	-62.8	-153.5	155.9	0	0	116.1
378	T	30	Very low	29.4	Very low	127 Å²	127	148.9 Å²	148.9	78%	0.779	77%	0.765	S	S	*	*			trans	-141	122.1	162.2	50.3	0	0	0	0	107.3
379	S	31.1	Very low	30.1	Very low	97 Å²	97	146.8 Å²	146.8	68%	0.678	76%	0.76	S	S	*	*			trans	33.4	128.1	141.4	51.4	0	0	0	0	119.5
380	D	27.2	Very low	30.3	Very low	155 Å²	155	143.6 Å²	143.6	83%	0.829	76%	0.758	S	S	*	*			cis	-151.7	169.8	24.2	-95.9	-37.4	0	0	0	116.6
381	S	31.2	Very low	30.3	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	76%	0.759	S	S	*	*			trans	-68.2	172.5	171.8	57.8	0	0	0	0	113.4
382	H	33	Very low	30.3	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.787	76%	0.757	S	S	*	*			cis	-152.1	169.4	-5.7	-133.9	-135.4	0	0	0	106.8
383	E	31.2	Very low	30.1	Very low	159 Å²	159	137.2 Å²	137.2	74%	0.743	75%	0.753	S	S	*	*				-174	150.8	78.3	-108	-167.6	-155.8	0	0	113.6
384	N	31.5	Very low	30.2	Very low	114 Å²	114	141.1 Å²	141.1	61%	0.61	75%	0.752	S	S	*	*			trans	77.2	119.9	149.8	-56.6	-24.6	0	0	0	123.9
385	N	30.3	Very low	30.8	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	75%	0.752	S	S	*	*			trans	63.9	116.2	150.3	-61.8	-32.7	0	0	0	119.6
386	M	32.7	Very low	30.9	Very low	159 Å²	159	144.4 Å²	144.4	78%	0.783	76%	0.762	S	S	*	*				51.2	129.4	70.6	-54.9	-53.9	-167.4	0	0	113.2
387	D	31.4	Very low	30.8	Very low	156 Å²	156	138.7 Å²	138.7	83%	0.834	76%	0.759	S	S	*	*			cis	-137.7	170.9	11.8	-94.4	-59.8	0	0	0	112.2
388	G	28.5	Very low	30.8	Very low	67 Å²	67	142 Å²	142	69%	0.691	77%	0.765	S	S	*	*			trans	-94.5	-147.6	174.3	0	0	0	0	0	114
389	P	44.2	Very low	31.2	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	76%	0.759	S	S	*	*			cis	-144.5	-169.4	-4.7	43.8	-24.8	0	0	0	115.5
390	I	29.6	Very low	31	Very low	148 Å²	148	143.3 Å²	143.3	76%	0.759	76%	0.76	S	S	*	*			trans	74.8	102.4	149.7	-77.1	168.1	0	0	0	119.9
391	S	27.4	Very low	30.8	Very low	92 Å²	92	142.9 Å²	142.9	64%	0.643	75%	0.753	S	S	*	*				85.4	119.2	122.4	-68.6	0	0	0	0	125
392	L	26.2	Very low	30.5	Very low	155 Å²	155	148.8 Å²	148.8	81%	0.812	76%	0.76	S	S	*	*				86.5	154.9	121.7	-71.4	173.9	0	0	0	122.6
393	I	29.8	Very low	30.2	Very low	157 Å²	157	148.4 Å²	148.4	81%	0.805	76%	0.759	S	S	*	*			trans	83.4	119.9	162.4	-66.1	147	0	0	0	118.6
394	R	28.9	Very low	29.8	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	76%	0.763	S	S	*	*			trans	-93.5	145.1	176.1	166.5	-172.1	-168.2	156.9	7.5	110.5
395	P	37.8	Very low	29.7	Very low	121 Å²	121	145.2 Å²	145.2	79%	0.786	77%	0.769	S	S	*	*			trans	-131.7	171.9	134.4	16.7	4.1	0	0	0	114.2
396	K	29.8	Very low	30.4	Very low	180 Å²	180	144 Å²	144	78%	0.783	77%	0.769	S	S	*	*			trans	-96.1	147.1	170.3	-54.8	164.1	176.1	172.7	0	109.4
397	S	26.6	Very low	30.2	Very low	123 Å²	123	141 Å²	141	86%	0.86	76%	0.764	S	S	*	*			trans	-172.4	150	133.1	47.4	0	0	0	0	113.6
398	R	28.8	Very low	30.1	Very low	237 Å²	237	140.6 Å²	140.6	89%	0.894	76%	0.762	S	S	*	*			trans	-102.6	171.7	155.4	-118	-171.8	172.7	-177.3	-2.7	105.9
399	P	38.5	Very low	30.1	Very low	101 Å²	101	142.6 Å²	142.6	66%	0.656	77%	0.765	S	S	*	*			cis	-144.4	-176.7	19.7	43.9	-24.7	0	0	0	117.7
400	Q	27.1	Very low	29.5	Very low	152 Å²	152	141.9 Å²	141.9	71%	0.71	76%	0.762	S	S	*	*			trans	90.7	140.1	136.9	-159.3	153	-20.5	0	0	121.9
401	E	23.1	Very low	30	Very low	145 Å²	145	142.2 Å²	142.2	68%	0.678	76%	0.764	S	S	*	*			trans	65.2	118.8	164.2	-83.3	159	-134	0	0	118.7
402	R	24.6	Very low	30.2	Very low	222 Å²	222	144 Å²	144	84%	0.838	77%	0.766	S	S	*	*				82.7	105.5	79.1	-86.9	-161.3	155.1	171.3	-5.3	112.5
403	E	25.3	Very low	31	Very low	162 Å²	162	140.7 Å²	140.7	76%	0.757	76%	0.756	S	S	*	*				100.8	104.3	87.1	-82.4	-73	173.9	0	0	111.4
404	A	24.3	Very low	31.2	Very low	100 Å²	100	138.5 Å²	138.5	83%	0.826	75%	0.75	S	S	*	*			trans	-167.2	110.6	159.3	0	0	0	0	0	111.8
405	S	28.8	Very low	31.5	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	75%	0.747	S	S	*	*			trans	-83.6	-161.9	158.4	-36	0	0	0	0	108.7
406	P	45.5	Very low	31.6	Very low	116 Å²	116	133.8 Å²	133.8	75%	0.753	74%	0.742	S	S	*	*			cis	-119	-170.9	10.3	40.4	-20.1	0	0	0	111.9
407	S	27.9	Very low	31.9	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	74%	0.744	S	S	*	*			cis	-164.2	142.8	35.7	54.2	0	0	0	0	116
408	N	29.5	Very low	32.2	Very low	147 Å²	147	132.8 Å²	132.8	79%	0.786	74%	0.738	S	S	*	*				40.2	140.3	124.6	-49.2	-9.9	0	0	0	119.3
409	S	28.1	Very low	32.4	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	72%	0.721	S	S	*	*			cis	-131.4	145.6	37.6	50.4	0	0	0	0	113.5
410	C	32.4	Very low	32	Very low	101 Å²	101	129.4 Å²	129.4	68%	0.682	73%	0.732	S	S	*	*				62.3	145.7	72.3	-49.2	0	0	0	0	114.6
411	L	40.6	Very low	32.4	Very low	155 Å²	155	129.5 Å²	129.5	81%	0.812	74%	0.737	S	S	*	*			cis	-163.3	-175.8	-16.2	-101.6	177.2	0	0	0	105.1
412	D	30.8	Very low	32.6	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	75%	0.748	S	S	*	*			cis	-150.7	-164.7	12.4	-149.8	29.8	0	0	0	106.9
413	S	41.9	Very low	32.8	Very low	86 Å²	86	129.9 Å²	129.9	60%	0.601	75%	0.745	S	S	*	*			cis	-162.3	-174.4	-2.9	-144.5	0	0	0	0	105.2
414	T	35.8	Very low	32.9	Very low	111 Å²	111	130 Å²	130	68%	0.681	75%	0.746	S	S	*	*			cis	-151.2	177.3	-1	30.3	0	0	0	0	104.8
415	D	35.3	Very low	33	Very low	134 Å²	134	130.2 Å²	130.2	72%	0.717	74%	0.741	S	S	*	*			cis	-165	-175	-10.6	-105.4	-29.3	0	0	0	106.3
416	S	39.4	Very low	32.9	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	75%	0.745	S	S	*	*			cis	156.4	125.4	-39.3	-71.1	0	0	0	0	107.9
417	E	35	Very low	32.1	Very low	176 Å²	176	138.2 Å²	138.2	82%	0.822	75%	0.749	S	S	*	*			cis	-119.2	-125.7	-13.4	-69.3	-170.2	63.3	0	0	108.5	S419	E417-S419 PolarHBondContact OE1-OG 3.01Å
418	S	34	Very low	31.9	Very low	106 Å²	106	137.4 Å²	137.4	74%	0.741	76%	0.756	S	S	*	*			cis	-159.4	152.2	-13.9	27.8	0	0	0	0	108.4
419	S	32.1	Very low	31.8	Very low	78 Å²	78	138.1 Å²	138.1	55%	0.545	76%	0.76	S	S	.	*			cis	101.4	97.5	15.4	76.8	0	0	0	0	116.3	E417	E417-S419 PolarHBondContact OE1-OG 3.01Å
420	H	30	Very low	32.4	Very low	189 Å²	189	138.6 Å²	138.6	88%	0.875	76%	0.761	S	S	*	*				170.7	151.5	124.7	-101.9	-81.9	0	0	0	115.7
421	D	35	Very low	32.2	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	76%	0.76	S	S	*	*			trans	-86.2	157.6	170.2	-73.5	-92.5	0	0	0	113.5
422	D	27.4	Very low	31.7	Very low	167 Å²	167	138.4 Å²	138.4	89%	0.893	76%	0.764	S	S	*	*			trans	-163.1	-177	137.2	-135.8	-34.2	0	0	0	115.6
423	R	29.2	Very low	31.4	Very low	208 Å²	208	139.4 Å²	139.4	79%	0.785	77%	0.769	S	S	*	*			trans	-123.4	146.5	-160.7	-115.9	-177.2	162.8	122.9	-8	116.1
424	Q	28.8	Very low	31.3	Very low	166 Å²	166	139.7 Å²	139.7	78%	0.776	77%	0.769	S	S	*	*			trans	77.8	143.6	145.6	-72.3	-179.5	-26.5	0	0	124
425	S	25.5	Very low	30.9	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	78%	0.775	S	S	*	*			trans	73.6	112.7	153	-84.3	0	0	0	0	122
426	Y	27.5	Very low	30.4	Very low	213 Å²	213	147.5 Å²	147.5	84%	0.835	78%	0.781	S	S	*	*				-157.9	-168.4	93.4	-117.2	-85.4	0	0	0	111.6
427	Q	27.1	Very low	29.8	Very low	177 Å²	177	149.8 Å²	149.8	83%	0.827	78%	0.779	S	S	*	*			trans	-104.6	152.9	-151.4	-62.2	162.7	-36	0	0	116
428	G	25.4	Very low	29.3	Very low	80 Å²	80	149 Å²	149	83%	0.825	78%	0.775	S	S	*	*			trans	177.3	92.5	168.8	0	0	0	0	0	114.8
429	N	25.5	Very low	29.2	Very low	162 Å²	162	149.3 Å²	149.3	87%	0.866	78%	0.777	S	S	*	*			trans	-118.8	167.8	171.4	-106.4	-31.6	0	0	0	108.5
430	P	42.8	Very low	29.3	Very low	119 Å²	119	151.8 Å²	151.8	77%	0.773	79%	0.792	S	S	*	*			cis	-122.6	-164	13.1	35.4	-12.8	0	0	0	111.8
431	A	27.6	Very low	29	Very low	81 Å²	81	147.5 Å²	147.5	67%	0.669	79%	0.789	S	S	*	*			cis	-163.7	151.4	26.5	0	0	0	0	0	117.2
432	L	29.8	Very low	28.5	Very low	171 Å²	171	148.6 Å²	148.6	90%	0.895	78%	0.783	S	S	*	*			trans	64.5	94.7	145.2	-64	169.9	0	0	0	122.3
433	N	25.4	Very low	28.6	Very low	148 Å²	148	148 Å²	148	79%	0.791	78%	0.776	S	S	*	*			trans	-61.8	175.7	141.7	-137.6	-5.5	0	0	0	110.1
434	P	39.4	Very low	28.6	Very low	92 Å²	92	144.9 Å²	144.9	60%	0.597	77%	0.769	S	S	*	*			cis	-158.3	-176.8	39.9	47.4	-25.1	0	0	0	120.5
435	K	26.3	Very low	28.8	Very low	189 Å²	189	145 Å²	145	82%	0.822	77%	0.769	S	S	*	*			trans	71.1	120.5	158.4	-65.9	159.5	-169.5	175.6	0	117.1
436	R	26.3	Very low	28.8	Very low	220 Å²	220	148 Å²	148	83%	0.83	78%	0.777	S	S	*	*			cis	77.7	103.8	12.6	-150.9	-151.8	-175.3	-177.4	4.8	116.7
437	K	26.3	Very low	29.3	Very low	145 Å²	145	143.8 Å²	143.8	63%	0.63	77%	0.773	S	S	*	*			trans	141.1	127.2	130.2	-81.7	-172.4	149.3	-142.5	0	117
438	Q	24.4	Very low	29.4	Very low	159 Å²	159	145.5 Å²	145.5	74%	0.743	78%	0.778	S	S	*	*			trans	66.7	124.4	133.7	-61.5	177.7	-78.6	0	0	121.3
439	S	31.6	Very low	29.8	Very low	114 Å²	114	146 Å²	146	80%	0.797	77%	0.774	S	S	*	*			trans	-83.6	157.9	156.7	35.9	0	0	0	0	112.1
440	P	34	Very low	30.1	Very low	130 Å²	130	146.2 Å²	146.2	84%	0.844	78%	0.775	S	S	*	*			trans	-112.4	174.8	147.7	37	-28.2	0	0	0	111.1
441	A	24.9	Very low	29.2	Very low	99 Å²	99	147.6 Å²	147.6	82%	0.818	78%	0.775	S	S	*	*			trans	-123.3	-178.8	-174.3	0	0	0	0	0	112.8
442	Y	24	Very low	29.7	Very low	177 Å²	177	147.1 Å²	147.1	69%	0.694	77%	0.772	S	S	*	*			trans	84.5	108.5	157.7	-158.7	-111.5	0	0	0	118.5
443	M	29.6	Very low	29.7	Very low	154 Å²	154	145.5 Å²	145.5	76%	0.759	77%	0.769	S	S	*	*				-165.3	173.1	119.2	-101.9	-58.8	178.3	0	0	111.3
444	K	29.5	Very low	29.9	Very low	143 Å²	143	148 Å²	148	62%	0.622	77%	0.773	S	S	*	*			trans	-82.8	151.8	-155.5	-65.6	176.3	173	-173.1	0	117.4
445	E	31.8	Very low	29.3	Very low	168 Å²	168	147.8 Å²	147.8	79%	0.785	78%	0.779	S	S	*	*			trans	24.4	130.2	130.1	-51.5	165.5	118.6	0	0	119.9
446	D	26.1	Very low	29.5	Very low	166 Å²	166	144.9 Å²	144.9	89%	0.888	78%	0.779	S	S	*	*			trans	-152.6	162.7	130.2	-140.5	-28.7	0	0	0	111.6
447	V	38.6	Very low	30	Very low	126 Å²	126	144.7 Å²	144.7	76%	0.764	79%	0.785	S	S	*	*			trans	-106.5	133.6	-163.9	176.6	0	0	0	0	114.1
448	K	27.6	Very low	30.1	Very low	212 Å²	212	141 Å²	141	92%	0.922	79%	0.787	S	S	*	*			trans	-161.5	150.7	149	-111.1	149.4	-171.2	167.8	0	112.8
449	A	33.4	Very low	30.7	Very low	91 Å²	91	138.7 Å²	138.7	75%	0.752	79%	0.789	S	S	*	*			trans	-117.7	143	-176.4	0	0	0	0	0	111.9
450	L	32.9	Very low	31.4	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	79%	0.79	S	S	*	*			trans	171.5	142.1	167.5	-93	150.3	0	0	0	105.3
451	D	24.6	Very low	32	Very low	148 Å²	148	143 Å²	143	79%	0.791	79%	0.787	S	S	*	*			cis	-150.7	178.1	-14.5	-160.2	-9.7	0	0	0	107.9
452	A	36.8	Very low	33.2	Very low	72 Å²	72	141.4 Å²	141.4	60%	0.595	76%	0.764	S	S	*	*			trans	-82.8	-179.6	-177.7	0	0	0	0	0	114.4
453	T	31	Very low	34.8	Very low	136 Å²	136	137 Å²	137	83%	0.834	75%	0.752	S	S	*	*			trans	77.2	140.4	-178.5	82.8	0	0	0	0	114.5
454	K	29.8	Very low	36.2	Very low	201 Å²	201	133.5 Å²	133.5	87%	0.874	73%	0.731	S	S	*	*			cis	-136.8	129.5	2.6	-110.6	152.6	-174.4	171.5	0	108.8
455	A	25.9	Very low	37.5	Very low	87 Å²	87	133.7 Å²	133.7	72%	0.719	73%	0.731	S	S	*	*			trans	-91.7	142.6	166.3	0	0	0	0	0	110.9	K457	A455-K457 PolarHBondContact O-N 3.43Å
456	P	30.6	Very low	38.8	Very low	128 Å²	128	128.4 Å²	128.4	83%	0.831	71%	0.71	S	S	*	*			trans	-70.9	125	176.4	28.7	-33.4	0	0	0	111	G458	P456-G458 PolarHBondContact O-N 3.33Å
457	K	36.2	Very low	40.6	Very low	217 Å²	217	126.3 Å²	126.3	94%	0.943	69%	0.694	S	S	*	*			trans	-80.3	81.5	-176.6	-69.9	-179.8	177.8	176.2	0	112.4	A455	A455-K457 PolarHBondContact O-N 3.43Å
458	G	28.7	Very low	41.4	Very low	66 Å²	66	122.4 Å²	122.4	68%	0.68	67%	0.669	S	S	*	*			trans	-80.3	132.2	154.1	0	0	0	0	0	110	P456 L460	P456-G458 PolarHBondContact O-N 3.33Å; G458-L460 PolarHBondContact O-N 2.88Å
459	S	37.8	Very low	42.6	Very low	112 Å²	112	116.7 Å²	116.7	78%	0.783	67%	0.67	S	S	*	*			trans	-80.5	80.2	-170.2	52.9	0	0	0	0	113.8	K461	S459-K461 PolarHBondContact O-N 2.82Å
460	L	46.3	Very low	44	Very low	158 Å²	158	120.4 Å²	120.4	83%	0.827	67%	0.672	S	S	*	*			trans	-71.8	65	159.6	-82.6	166.3	0	0	0	110.8	G458 I463	G458-L460 PolarHBondContact O-N 2.88Å; L460-I463 HydrophobicContact CD2-CD1 4.45Å
461	K	46.5	Very low	44.9	Very low	177 Å²	177	115 Å²	115	77%	0.77	66%	0.656	S	S	*	*			trans	-112.3	155.9	166.3	-68.3	-171.9	173	-171.5	0	108.3	S459	S459-K461 PolarHBondContact O-N 2.82Å
462	D	50	Low	46.5	Very low	64 Å²	64	114.2 Å²	114.2	34%	0.342	65%	0.647	S	S	.	*			trans	71.6	37.4	180	-77.8	39.5	0	0	0	116.9	Y464 K478	D462-Y464 HydrophobicContact CB-CD2 4.35Å; D462-Y464 HydrophobicContact CB-CE2 3.61Å; D462-Y464 WeakPolarHBondContact O-CD2 3.42Å; D462-Y464 WeakPolarHBondContact OD2-CE2 3.5Å; D462-Y464 VanDerWaalsContact OD2-CZ 3.26Å; D462-Y464 PolarHBondContact OD2-OH 3.36Å; D462-K478 IonicContact OD2-NZ 3.38Å; D462-K478 PolarHBondContact OD2-NZ 3.46Å
463	I	56.1	Low	47.4	Very low	85 Å²	85	115 Å²	115	44%	0.436	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.1	106.5	150.1	-58.5	176.1	0	0	0	107.8	L460 R475 F477	L460-I463 HydrophobicContact CD2-CD1 4.45Å; I463-R475 HydrophobicContact CG2-CB 4.44Å; I463-R475 HydrophobicContact CG2-CG 4.28Å; I463-F477 HydrophobicContact CG1-CE1 4.45Å
464	Y	59.2	Low	49	Very low	81 Å²	81	111.4 Å²	111.4	32%	0.318	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.3	127.4	176.5	-69.5	-101	0	0	0	109.4	D462 V466 A476 K478 L485	D462-Y464 HydrophobicContact CB-CD2 4.35Å; D462-Y464 HydrophobicContact CB-CE2 3.61Å; D462-Y464 WeakPolarHBondContact O-CD2 3.42Å; D462-Y464 WeakPolarHBondContact OD2-CE2 3.5Å; D462-Y464 VanDerWaalsContact OD2-CZ 3.26Å; D462-Y464 PolarHBondContact OD2-OH 3.36Å; Y464-V466 PolarHBondContact O-N 3.13Å; Y464-A476 PolarHBondContact N-O 2.93Å; Y464-A476 PolarHBondContact O-N 3.37Å; Y464-K478 HydrophobicContact CD2-CB 4.09Å; Y464-K478 HydrophobicContact CD2-CD 4.39Å; Y464-K478 HydrophobicContact CE2-CB 3.72Å; Y464-K478 HydrophobicContact CE2-CD 3.41Å; Y464-K478 VanDerWaalsContact CE2-CD 3.41Å; Y464-K478 HydrophobicContact CE2-CG 4.25Å; Y464-K478 WeakPolarHBondContact OH-CD 3.4Å; Y464-K478 PolarHBondContact OH-NZ 3.05Å; Y464-L485 HydrophobicContact CD2-CD2 3.95Å; Y464-L485 HydrophobicContact CE2-CD2 4.44Å; Y464-L485 HydrophobicContact CG-CD2 4.28Å
465	K	57.2	Low	50.7	Low	146 Å²	146	109.8 Å²	109.8	64%	0.635	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.7	106.2	170.2	-65.5	-176.7	170.8	-155.7	0	108.2	F467 Q473	K465-F467 HydrophobicContact CB-CE2 4.33Å; K465-Q473 HydrophobicContact CB-CG 4.19Å; K465-Q473 VanDerWaalsContact CD-OE1 3.31Å; K465-Q473 HydrophobicContact CG-CG 4.41Å
466	V	59.5	Low	52.7	Low	57 Å²	57	105.7 Å²	105.7	35%	0.345	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.9	123	178	179.8	0	0	0	0	107.3	Y464 I474 A476	Y464-V466 PolarHBondContact O-N 3.13Å; V466-I474 PolarHBondContact N-O 2.7Å; V466-I474 VanDerWaalsContact N-O 3.07Å; V466-I474 CarbonylContact O-C 3.56Å; V466-I474 WeakPolarHBondContact O-CA 3.19Å; V466-I474 WeakPolarHBondContact O-CB 3.41Å; V466-I474 PolarHBondContact O-N 3.48Å; V466-A476 HydrophobicContact CB-CB 4.4Å; V466-A476 HydrophobicContact CG2-CB 3.64Å
467	F	63.4	Low	54.8	Low	123 Å²	123	101.3 Å²	101.3	54%	0.539	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	141.6	178	-63.2	-94.2	0	0	0	109.7	K465 G471 E472 Q473	K465-F467 HydrophobicContact CB-CE2 4.33Å; F467-G471 WeakPolarHBondContact CD1-O 3.47Å; F467-E472 CarbonylContact C-O 3.56Å; F467-E472 VanDerWaalsContact CA-O 3.26Å; F467-E472 WeakPolarHBondContact CA-O 3.34Å; F467-Q473 HydrophobicContact CD1-CB 3.86Å; F467-Q473 HydrophobicContact CD1-CG 4.11Å; F467-Q473 HydrophobicContact CE1-CB 3.56Å; F467-Q473 HydrophobicContact CE1-CG 3.62Å; F467-Q473 HydrophobicContact CE2-CG 4.32Å; F467-Q473 HydrophobicContact CZ-CB 4.22Å; F467-Q473 HydrophobicContact CZ-CG 3.74Å
468	N	56.6	Low	55.9	Low	44 Å²	44	94 Å²	94	24%	0.235	50%	0.504	C	S	.	.			trans	-74.9	174.4	169.1	82.7	-11.5	0	0	0	110.5	E470 G471 E472 I474	N468-E470 PolarHBondContact ND2-OE2 2.77Å; N468-E470 VanDerWaalsContact ND2-OE2 3.07Å; N468-E470 PolarHBondContact O-N 3.31Å; N468-E470 VanDerWaalsContact O-N 3.09Å; N468-E470 WeakPolarHBondContact OD1-CA 3.46Å; N468-E470 WeakPolarHBondContact OD1-CB 3.4Å; N468-E470 PolarHBondContact OD1-N 2.74Å; N468-G471 PolarHBondContact O-N 2.83Å; N468-G471 PolarHBondContact OD1-N 3.31Å; N468-E472 PolarHBondContact N-O 3.35Å; N468-E472 PolarHBondContact OD1-N 3.27Å; N468-I474 HydrophobicContact CB-CD1 4.04Å
469	G	52.2	Low	57.9	Low	92 Å²	92	90.9 Å²	90.9	95%	0.948	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.3	178.2	0	0	0	0	0	115.2
470	E	62.2	Low	58.8	Low	169 Å²	169	92.5 Å²	92.5	79%	0.79	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-0.4	-178.5	-57.8	166	148.3	0	0	111.6	N468	N468-E470 PolarHBondContact ND2-OE2 2.77Å; N468-E470 VanDerWaalsContact ND2-OE2 3.07Å; N468-E470 PolarHBondContact O-N 3.31Å; N468-E470 VanDerWaalsContact O-N 3.09Å; N468-E470 WeakPolarHBondContact OD1-CA 3.46Å; N468-E470 WeakPolarHBondContact OD1-CB 3.4Å; N468-E470 PolarHBondContact OD1-N 2.74Å
471	G	53.2	Low	59.1	Low	52 Å²	52	90.2 Å²	90.2	54%	0.536	45%	0.452	S	S	.	.	S	Bend	trans	93.7	2.9	177.4	0	0	0	0	0	115.9	F467 N468	F467-G471 WeakPolarHBondContact CD1-O 3.47Å; N468-G471 PolarHBondContact O-N 2.83Å; N468-G471 PolarHBondContact OD1-N 3.31Å
472	E	56.9	Low	59.8	Low	131 Å²	131	84.1 Å²	84.1	61%	0.612	43%	0.431	S	S	*	.			trans	-78.1	133.9	179.2	-60.6	-157.6	132.1	0	0	112.6	F467 N468 I474	F467-E472 CarbonylContact C-O 3.56Å; F467-E472 VanDerWaalsContact CA-O 3.26Å; F467-E472 WeakPolarHBondContact CA-O 3.34Å; N468-E472 PolarHBondContact N-O 3.35Å; N468-E472 PolarHBondContact OD1-N 3.27Å; E472-I474 PolarHBondContact O-N 3.25Å
473	Q	56.6	Low	60.4	Low	89 Å²	89	91.1 Å²	91.1	42%	0.416	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	90.8	-175.2	-163.2	-152	-99.1	0	0	113	K465 F467	K465-Q473 HydrophobicContact CB-CG 4.19Å; K465-Q473 VanDerWaalsContact CD-OE1 3.31Å; K465-Q473 HydrophobicContact CG-CG 4.41Å; F467-Q473 HydrophobicContact CD1-CB 3.86Å; F467-Q473 HydrophobicContact CD1-CG 4.11Å; F467-Q473 HydrophobicContact CE1-CB 3.56Å; F467-Q473 HydrophobicContact CE1-CG 3.62Å; F467-Q473 HydrophobicContact CE2-CG 4.32Å; F467-Q473 HydrophobicContact CZ-CB 4.22Å; F467-Q473 HydrophobicContact CZ-CG 3.74Å
474	I	64.3	Low	60.9	Low	60 Å²	60	90.4 Å²	90.4	31%	0.308	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141.8	171.1	-55	178.9	0	0	0	110.4	V466 N468 E472 L487	V466-I474 PolarHBondContact N-O 2.7Å; V466-I474 VanDerWaalsContact N-O 3.07Å; V466-I474 CarbonylContact O-C 3.56Å; V466-I474 WeakPolarHBondContact O-CA 3.19Å; V466-I474 WeakPolarHBondContact O-CB 3.41Å; V466-I474 PolarHBondContact O-N 3.48Å; N468-I474 HydrophobicContact CB-CD1 4.04Å; E472-I474 PolarHBondContact O-N 3.25Å; I474-L487 HydrophobicContact CG2-CB 4.05Å; I474-L487 HydrophobicContact CG2-CD2 4.08Å; I474-L487 HydrophobicContact CG2-CG 4.46Å
475	R	64.6	Low	61.2	Low	168 Å²	168	91 Å²	91	63%	0.634	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	112.6	175.5	-78.1	179.1	-84.2	-144.9	-5.5	109.9	I463 F477	I463-R475 HydrophobicContact CG2-CB 4.44Å; I463-R475 HydrophobicContact CG2-CG 4.28Å; R475-F477 HydrophobicContact CB-CE2 4.26Å; R475-F477 HydrophobicContact CB-CZ 4.35Å
476	A	68.8	Low	62.1	Low	0 Å²	0	85.6 Å²	85.6	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134.1	177.2	0	0	0	0	0	111.9	Y464 V466 L485 F486 L487	Y464-A476 PolarHBondContact N-O 2.93Å; Y464-A476 PolarHBondContact O-N 3.37Å; V466-A476 HydrophobicContact CB-CB 4.4Å; V466-A476 HydrophobicContact CG2-CB 3.64Å; A476-L485 HydrophobicContact CB-CD2 4.42Å; A476-F486 CarbonylContact C-O 3.46Å; A476-F486 WeakPolarHBondContact CA-O 3.49Å; A476-L487 HydrophobicContact CB-CD2 3.79Å
477	F	74.2	Confident	62.6	Low	36 Å²	36	88 Å²	88	16%	0.158	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126	-179.2	-57.3	-88.2	0	0	0	109.7	I463 R475 L485 F486 H489 Y492	I463-F477 HydrophobicContact CG1-CE1 4.45Å; R475-F477 HydrophobicContact CB-CE2 4.26Å; R475-F477 HydrophobicContact CB-CZ 4.35Å; F477-L485 WeakPolarHBondContact O-CA 3.44Å; F477-F486 PolarHBondContact N-O 2.86Å; F477-F486 PolarHBondContact O-N 3.07Å; F477-H489 HydrophobicContact CD2-CB 4.31Å; F477-H489 AromaticContact CE1-CD2 3.67Å; F477-H489 HydrophobicContact CE2-CB 3.73Å; F477-H489 HydrophobicContact CZ-CB 3.87Å; F477-H489 AromaticContact CZ-CD2 3.82Å; F477-Y492 HydrophobicContact CB-CD1 3.96Å; F477-Y492 HydrophobicContact CB-CD2 3.84Å; F477-Y492 HydrophobicContact CB-CE1 4.41Å; F477-Y492 HydrophobicContact CB-CE2 4.31Å; F477-Y492 HydrophobicContact CB-CG 3.66Å; F477-Y492 HydrophobicContact CD1-CD1 4.46Å; F477-Y492 HydrophobicContact CG-CD1 4.31Å; F477-Y492 HydrophobicContact CG-CG 4.32Å
478	K	60.6	Low	62.9	Low	64 Å²	64	85.2 Å²	85.2	28%	0.278	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.7	-178.4	-171.3	178.6	171.3	-165.3	0	110.6	D462 Y464 E480 L485	D462-K478 IonicContact OD2-NZ 3.38Å; D462-K478 PolarHBondContact OD2-NZ 3.46Å; Y464-K478 HydrophobicContact CD2-CB 4.09Å; Y464-K478 HydrophobicContact CD2-CD 4.39Å; Y464-K478 HydrophobicContact CE2-CB 3.72Å; Y464-K478 HydrophobicContact CE2-CD 3.41Å; Y464-K478 VanDerWaalsContact CE2-CD 3.41Å; Y464-K478 HydrophobicContact CE2-CG 4.25Å; Y464-K478 WeakPolarHBondContact OH-CD 3.4Å; Y464-K478 PolarHBondContact OH-NZ 3.05Å; K478-E480 PolarHBondContact O-N 2.67Å; K478-L485 HydrophobicContact CB-CD2 3.68Å; K478-L485 HydrophobicContact CD-CD2 4.45Å; K478-L485 HydrophobicContact CG-CD2 4.04Å
479	C	70.5	Confident	63.3	Low	0 Å²	0	87.6 Å²	87.6	0%	0	45%	0.448	C	S	.	.			trans	-80.4	108.2	171.2	-179.5	0	0	0	0	109.8	H481 C482 R483 V484 F486 Y492 M496	C479-H481 PolarHBondContact O-N 3.27Å; C479-H481 VanDerWaalsContact O-N 3.16Å; C479-C482 VanDerWaalsContact CB-SG 3.5Å; C479-C482 PolarHBondContact O-N 3.22Å; C479-R483 WeakPolarHBondContact O-CA 3.31Å; C479-R483 PolarHBondContact O-N 2.9Å; C479-V484 PolarHBondContact N-O 2.72Å; C479-F486 HydrophobicContact CB-CD2 4.47Å; C479-F486 HydrophobicContact CB-CE2 3.93Å; C479-Y492 HydrophobicContact CB-CD2 4.43Å; C479-Y492 HydrophobicContact CB-CE2 3.9Å; C479-M496 HydrophobicContact CB-SD 4.42Å
480	E	55.5	Low	63.9	Low	147 Å²	147	87 Å²	87	69%	0.687	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.2	-179.8	-60.7	-175	137.2	0	0	113.3	K478	K478-E480 PolarHBondContact O-N 2.67Å
481	H	53.3	Low	63.9	Low	109 Å²	109	83.7 Å²	83.7	51%	0.505	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.2	-176.1	-73.3	53.6	0	0	0	113.7	C479 Y501	C479-H481 PolarHBondContact O-N 3.27Å; C479-H481 VanDerWaalsContact O-N 3.16Å; H481-Y501 AromaticContact NE2-CE2 3.64Å
482	C	60.3	Low	64.8	Low	49 Å²	49	83.5 Å²	83.5	33%	0.331	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-4.7	-179.6	67.6	0	0	0	0	113.9	C479 V484 H495	C479-C482 VanDerWaalsContact CB-SG 3.5Å; C479-C482 PolarHBondContact O-N 3.22Å; C482-V484 HydrophobicContact CB-CG2 4.28Å; C482-V484 PolarHBondContact O-N 3.42Å; C482-V484 VanDerWaalsContact O-N 3.17Å; C482-V484 VanDerWaalsContact SG-CB 3.59Å; C482-H495 PolarHBondContact SG-NE2 2.65Å
483	R	63	Low	65.1	Low	211 Å²	211	80.3 Å²	80.3	80%	0.796	38%	0.384	S	S	*	.			trans	60.7	9.6	-175.2	-57	179.3	178.6	176.5	-1.6	115.6	C479	C479-R483 WeakPolarHBondContact O-CA 3.31Å; C479-R483 PolarHBondContact O-N 2.9Å
484	V	65.9	Low	65.4	Low	70 Å²	70	80.5 Å²	80.5	42%	0.424	39%	0.387	S	S	.	.			trans	-74.1	139.1	175.6	-179.6	0	0	0	0	110.7	C479 C482 F486	C479-V484 PolarHBondContact N-O 2.72Å; C482-V484 HydrophobicContact CB-CG2 4.28Å; C482-V484 PolarHBondContact O-N 3.42Å; C482-V484 VanDerWaalsContact O-N 3.17Å; C482-V484 VanDerWaalsContact SG-CB 3.59Å; V484-F486 HydrophobicContact CB-CE2 3.77Å; V484-F486 HydrophobicContact CB-CZ 4.05Å; V484-F486 HydrophobicContact CG1-CD2 4.21Å; V484-F486 HydrophobicContact CG1-CE1 4.24Å; V484-F486 HydrophobicContact CG1-CE2 3.64Å; V484-F486 HydrophobicContact CG1-CZ 3.65Å
485	L	65.8	Low	65.3	Low	93 Å²	93	80 Å²	80	49%	0.487	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	134.4	171.6	-74.6	161.7	0	0	0	110.3	Y464 A476 F477 K478	Y464-L485 HydrophobicContact CD2-CD2 3.95Å; Y464-L485 HydrophobicContact CE2-CD2 4.44Å; Y464-L485 HydrophobicContact CG-CD2 4.28Å; A476-L485 HydrophobicContact CB-CD2 4.42Å; F477-L485 WeakPolarHBondContact O-CA 3.44Å; K478-L485 HydrophobicContact CB-CD2 3.68Å; K478-L485 HydrophobicContact CD-CD2 4.45Å; K478-L485 HydrophobicContact CG-CD2 4.04Å
486	F	75.9	Confident	65.2	Low	34 Å²	34	74 Å²	74	15%	0.149	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.7	178.3	-63.8	-92.3	0	0	0	109.3	A476 F477 C479 V484 D488 M491 Y492 H495	A476-F486 CarbonylContact C-O 3.46Å; A476-F486 WeakPolarHBondContact CA-O 3.49Å; F477-F486 PolarHBondContact N-O 2.86Å; F477-F486 PolarHBondContact O-N 3.07Å; C479-F486 HydrophobicContact CB-CD2 4.47Å; C479-F486 HydrophobicContact CB-CE2 3.93Å; V484-F486 HydrophobicContact CB-CE2 3.77Å; V484-F486 HydrophobicContact CB-CZ 4.05Å; V484-F486 HydrophobicContact CG1-CD2 4.21Å; V484-F486 HydrophobicContact CG1-CE1 4.24Å; V484-F486 HydrophobicContact CG1-CE2 3.64Å; V484-F486 HydrophobicContact CG1-CZ 3.65Å; F486-D488 VanDerWaalsContact C-N 3.25Å; F486-D488 PolarHBondContact O-N 3.41Å; F486-M491 HydrophobicContact CD1-CB 4.15Å; F486-Y492 AromaticContact CD2-CD2 3.89Å; F486-Y492 HydrophobicContact CD2-CD2 3.89Å; F486-Y492 HydrophobicContact CG-CD2 4.46Å; F486-H495 HydrophobicContact CE1-CB 4.12Å; F486-H495 HydrophobicContact CE2-CB 4.35Å; F486-H495 AromaticContact CE2-CD2 3.75Å; F486-H495 AromaticContact CE2-CG 3.99Å; F486-H495 HydrophobicContact CZ-CB 3.82Å; F486-H495 AromaticContact CZ-CD2 3.56Å; F486-H495 AromaticContact CZ-CE1 3.92Å; F486-H495 AromaticContact CZ-CG 3.4Å; F486-H495 AromaticContact CZ-ND1 3.64Å; F486-H495 AromaticContact CZ-NE2 3.9Å
487	L	71.9	Confident	64.7	Low	107 Å²	107	75.5 Å²	75.5	56%	0.56	38%	0.379	S	S	*	.	S	Bend	trans	-81.7	-4.6	177.8	-57.3	-176.9	0	0	0	113.4	I474 A476	I474-L487 HydrophobicContact CG2-CB 4.05Å; I474-L487 HydrophobicContact CG2-CD2 4.08Å; I474-L487 HydrophobicContact CG2-CG 4.46Å; A476-L487 HydrophobicContact CB-CD2 3.79Å
488	D	67.9	Low	63.7	Low	64 Å²	64	78.7 Å²	78.7	34%	0.342	41%	0.405	S	S	.	.			trans	-128.8	135.2	179.2	166.9	37.5	0	0	0	110.8	F486 V490 M491 Y492	F486-D488 VanDerWaalsContact C-N 3.25Å; F486-D488 PolarHBondContact O-N 3.41Å; D488-V490 VanDerWaalsContact CG-N 3.33Å; D488-V490 PolarHBondContact OD1-N 3.01Å; D488-V490 WeakPolarHBondContact OD2-CB 3.48Å; D488-V490 PolarHBondContact OD2-N 2.91Å; D488-M491 HydrophobicContact CB-CB 4.35Å; D488-M491 HydrophobicContact CB-CG 4.39Å; D488-M491 WeakPolarHBondContact OD2-CG 3.47Å; D488-M491 PolarHBondContact OD2-N 3.12Å; D488-Y492 WeakPolarHBondContact O-CB 3.33Å; D488-Y492 PolarHBondContact O-N 2.88Å
489	H	66.1	Low	63.2	Low	95 Å²	95	79.6 Å²	79.6	44%	0.44	41%	0.409	S	S	.	.	H	α-helix	trans	-70.3	-28.8	177.5	-171.8	-104.6	0	0	0	112.7	F477 Y492 T493	F477-H489 HydrophobicContact CD2-CB 4.31Å; F477-H489 AromaticContact CE1-CD2 3.67Å; F477-H489 HydrophobicContact CE2-CB 3.73Å; F477-H489 HydrophobicContact CZ-CB 3.87Å; F477-H489 AromaticContact CZ-CD2 3.82Å; H489-Y492 PolarHBondContact O-N 2.63Å; H489-T493 WeakPolarHBondContact O-CB 3.32Å; H489-T493 WeakPolarHBondContact O-CG2 3.44Å; H489-T493 PolarHBondContact O-N 3.14Å; H489-T493 PolarHBondContact O-OG1 2.81Å
490	V	65	Low	61.9	Low	80 Å²	80	82.3 Å²	82.3	49%	0.485	44%	0.437	S	S	.	.	H	α-helix	trans	-71.7	-47.7	177.7	-173.6	0	0	0	0	109.8	D488 Y492 T493 I494	D488-V490 VanDerWaalsContact CG-N 3.33Å; D488-V490 PolarHBondContact OD1-N 3.01Å; D488-V490 WeakPolarHBondContact OD2-CB 3.48Å; D488-V490 PolarHBondContact OD2-N 2.91Å; V490-Y492 VanDerWaalsContact C-N 3.31Å; V490-Y492 PolarHBondContact O-N 3.34Å; V490-T493 PolarHBondContact O-N 3.45Å; V490-T493 PolarHBondContact O-OG1 3.07Å; V490-T493 VanDerWaalsContact O-OG1 3.13Å; V490-I494 HydrophobicContact CG1-CD1 3.97Å; V490-I494 WeakPolarHBondContact O-CB 3.46Å; V490-I494 VanDerWaalsContact O-CG1 3.31Å; V490-I494 WeakPolarHBondContact O-CG1 3.48Å; V490-I494 PolarHBondContact O-N 3.15Å
491	M	61.7	Low	61.4	Low	99 Å²	99	81.7 Å²	81.7	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-59.3	-40.7	170.9	-69.3	-53.9	104.8	0	0	112.3	F486 D488 I494 H495	F486-M491 HydrophobicContact CD1-CB 4.15Å; D488-M491 HydrophobicContact CB-CB 4.35Å; D488-M491 HydrophobicContact CB-CG 4.39Å; D488-M491 WeakPolarHBondContact OD2-CG 3.47Å; D488-M491 PolarHBondContact OD2-N 3.12Å; M491-I494 HydrophobicContact CE-CD1 3.88Å; M491-H495 VanDerWaalsContact O-CB 3.29Å; M491-H495 WeakPolarHBondContact O-CB 3.46Å; M491-H495 PolarHBondContact O-N 3.45Å
492	Y	71	Confident	61	Low	47 Å²	47	86.5 Å²	86.5	18%	0.184	44%	0.443	C	S	.	.	H	α-helix	trans	-61.3	-47.7	175.2	178	-112	0	0	0	112.9	F477 C479 F486 D488 H489 V490 H495 M496	F477-Y492 HydrophobicContact CB-CD1 3.96Å; F477-Y492 HydrophobicContact CB-CD2 3.84Å; F477-Y492 HydrophobicContact CB-CE1 4.41Å; F477-Y492 HydrophobicContact CB-CE2 4.31Å; F477-Y492 HydrophobicContact CB-CG 3.66Å; F477-Y492 HydrophobicContact CD1-CD1 4.46Å; F477-Y492 HydrophobicContact CG-CD1 4.31Å; F477-Y492 HydrophobicContact CG-CG 4.32Å; C479-Y492 HydrophobicContact CB-CD2 4.43Å; C479-Y492 HydrophobicContact CB-CE2 3.9Å; F486-Y492 AromaticContact CD2-CD2 3.89Å; F486-Y492 HydrophobicContact CD2-CD2 3.89Å; F486-Y492 HydrophobicContact CG-CD2 4.46Å; D488-Y492 WeakPolarHBondContact O-CB 3.33Å; D488-Y492 PolarHBondContact O-N 2.88Å; H489-Y492 PolarHBondContact O-N 2.63Å; V490-Y492 VanDerWaalsContact C-N 3.31Å; V490-Y492 PolarHBondContact O-N 3.34Å; Y492-H495 WeakPolarHBondContact O-CB 3.22Å; Y492-H495 PolarHBondContact O-N 3.09Å; Y492-M496 HydrophobicContact CD1-CG 4.49Å; Y492-M496 HydrophobicContact CD2-CG 4.29Å; Y492-M496 HydrophobicContact CE1-CG 4.06Å; Y492-M496 HydrophobicContact CE2-CG 3.83Å; Y492-M496 HydrophobicContact CE2-SD 4.11Å; Y492-M496 WeakPolarHBondContact O-CG 3.19Å; Y492-M496 PolarHBondContact O-N 3.3Å
493	T	63.8	Low	60.6	Low	64 Å²	64	88.2 Å²	88.2	39%	0.393	45%	0.449	S	S	.	.	H	α-helix	trans	-70	-36.5	-179.2	44.2	0	0	0	0	112.5	H489 V490 H495 M496 G497	H489-T493 WeakPolarHBondContact O-CB 3.32Å; H489-T493 WeakPolarHBondContact O-CG2 3.44Å; H489-T493 PolarHBondContact O-N 3.14Å; H489-T493 PolarHBondContact O-OG1 2.81Å; V490-T493 PolarHBondContact O-N 3.45Å; V490-T493 PolarHBondContact O-OG1 3.07Å; V490-T493 VanDerWaalsContact O-OG1 3.13Å; T493-H495 VanDerWaalsContact C-N 3.34Å; T493-M496 PolarHBondContact O-N 3.41Å; T493-G497 PolarHBondContact O-N 3.49Å
494	I	63.2	Low	60.1	Low	93 Å²	93	81.1 Å²	81.1	48%	0.477	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-44.9	169.3	-69.3	168.8	0	0	0	110.3	V490 M491 G497 C498	V490-I494 HydrophobicContact CG1-CD1 3.97Å; V490-I494 WeakPolarHBondContact O-CB 3.46Å; V490-I494 VanDerWaalsContact O-CG1 3.31Å; V490-I494 WeakPolarHBondContact O-CG1 3.48Å; V490-I494 PolarHBondContact O-N 3.15Å; M491-I494 HydrophobicContact CE-CD1 3.88Å; I494-G497 PolarHBondContact O-N 3.38Å; I494-C498 PolarHBondContact O-N 3.33Å; I494-C498 PolarHBondContact O-SG 3.13Å; I494-C498 VanDerWaalsContact O-SG 3.35Å
495	H	61.9	Low	59.1	Low	50 Å²	50	80 Å²	80	23%	0.231	42%	0.422	C	S	.	.	H	α-helix	trans	-63.5	-41.9	178.1	-168.6	79.3	0	0	0	112.6	C482 F486 M491 Y492 T493 G497 C498 H499	C482-H495 PolarHBondContact SG-NE2 2.65Å; F486-H495 HydrophobicContact CE1-CB 4.12Å; F486-H495 HydrophobicContact CE2-CB 4.35Å; F486-H495 AromaticContact CE2-CD2 3.75Å; F486-H495 AromaticContact CE2-CG 3.99Å; F486-H495 HydrophobicContact CZ-CB 3.82Å; F486-H495 AromaticContact CZ-CD2 3.56Å; F486-H495 AromaticContact CZ-CE1 3.92Å; F486-H495 AromaticContact CZ-CG 3.4Å; F486-H495 AromaticContact CZ-ND1 3.64Å; F486-H495 AromaticContact CZ-NE2 3.9Å; M491-H495 VanDerWaalsContact O-CB 3.29Å; M491-H495 WeakPolarHBondContact O-CB 3.46Å; M491-H495 PolarHBondContact O-N 3.45Å; Y492-H495 WeakPolarHBondContact O-CB 3.22Å; Y492-H495 PolarHBondContact O-N 3.09Å; T493-H495 VanDerWaalsContact C-N 3.34Å; H495-G497 VanDerWaalsContact C-N 3.33Å; H495-C498 WeakPolarHBondContact O-CB 3.1Å; H495-C498 PolarHBondContact O-N 3.34Å; H495-H499 AromaticContact CD2-CD2 3.71Å; H495-H499 AromaticContact CD2-NE2 3.38Å; H495-H499 PolarHBondContact CD2-NE2 3.28Å; H495-H499 AromaticContact CE1-NE2 3.65Å; H495-H499 AromaticContact NE2-CD2 3.77Å; H495-H499 AromaticContact NE2-CE1 3.98Å; H495-H499 AromaticContact NE2-NE2 2.94Å; H495-H499 PolarHBondContact NE2-NE2 2.79Å; H495-H499 PolarHBondContact O-CD2 3.42Å; H495-H499 PolarHBondContact O-N 3.26Å
496	M	62.6	Low	58.3	Low	41 Å²	41	79.3 Å²	79.3	20%	0.202	42%	0.416	C	S	.	.	H	α-helix	trans	-65.9	-34.9	174	-68.5	-62.2	-73.3	0	0	112.3	C479 Y492 T493 H499 G500	C479-M496 HydrophobicContact CB-SD 4.42Å; Y492-M496 HydrophobicContact CD1-CG 4.49Å; Y492-M496 HydrophobicContact CD2-CG 4.29Å; Y492-M496 HydrophobicContact CE1-CG 4.06Å; Y492-M496 HydrophobicContact CE2-CG 3.83Å; Y492-M496 HydrophobicContact CE2-SD 4.11Å; Y492-M496 WeakPolarHBondContact O-CG 3.19Å; Y492-M496 PolarHBondContact O-N 3.3Å; T493-M496 PolarHBondContact O-N 3.41Å; M496-H499 PolarHBondContact O-N 3.07Å; M496-H499 VanDerWaalsContact O-N 3.15Å; M496-G500 PolarHBondContact O-N 3.42Å
497	G	58.4	Low	57.1	Low	33 Å²	33	78 Å²	78	34%	0.34	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-38.2	169.8	0	0	0	0	0	112.9	T493 I494 H495 H499 G500	T493-G497 PolarHBondContact O-N 3.49Å; I494-G497 PolarHBondContact O-N 3.38Å; H495-G497 VanDerWaalsContact C-N 3.33Å; G497-H499 PolarHBondContact O-N 2.93Å; G497-G500 PolarHBondContact O-N 3.22Å
498	C	52.7	Low	56	Low	103 Å²	103	80.2 Å²	80.2	70%	0.696	42%	0.424	S	S	*	.	H	α-helix	trans	-63.6	-25.7	172.5	-66.4	0	0	0	0	113.5	I494 H495 G500	I494-C498 PolarHBondContact O-N 3.33Å; I494-C498 PolarHBondContact O-SG 3.13Å; I494-C498 VanDerWaalsContact O-SG 3.35Å; H495-C498 WeakPolarHBondContact O-CB 3.1Å; H495-C498 PolarHBondContact O-N 3.34Å; C498-G500 VanDerWaalsContact C-N 3.33Å
499	H	50.4	Low	54.7	Low	82 Å²	82	84.5 Å²	84.5	38%	0.38	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.3	172.3	-65.3	-63.7	0	0	0	113.8	H495 M496 G497	H495-H499 AromaticContact CD2-CD2 3.71Å; H495-H499 AromaticContact CD2-NE2 3.38Å; H495-H499 PolarHBondContact CD2-NE2 3.28Å; H495-H499 AromaticContact CE1-NE2 3.65Å; H495-H499 AromaticContact NE2-CD2 3.77Å; H495-H499 AromaticContact NE2-CE1 3.98Å; H495-H499 AromaticContact NE2-NE2 2.94Å; H495-H499 PolarHBondContact NE2-NE2 2.79Å; H495-H499 PolarHBondContact O-CD2 3.42Å; H495-H499 PolarHBondContact O-N 3.26Å; M496-H499 PolarHBondContact O-N 3.07Å; M496-H499 VanDerWaalsContact O-N 3.15Å; G497-H499 PolarHBondContact O-N 2.93Å
500	G	42.5	Very low	53.5	Low	57 Å²	57	83 Å²	83	59%	0.588	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	23.5	165.3	0	0	0	0	0	116.8	M496 G497 C498 R502	M496-G500 PolarHBondContact O-N 3.42Å; G497-G500 PolarHBondContact O-N 3.22Å; C498-G500 VanDerWaalsContact C-N 3.33Å; G500-R502 PolarHBondContact O-N 2.88Å
501	Y	45.1	Very low	52.5	Low	134 Å²	134	81.5 Å²	81.5	53%	0.525	45%	0.445	S	S	.	.			trans	-84	90.8	174.6	-85.3	-88.6	0	0	0	112.5	H481	H481-Y501 AromaticContact NE2-CE2 3.64Å
502	R	46.8	Very low	51.6	Low	210 Å²	210	82.1 Å²	82.1	79%	0.792	44%	0.443	S	S	*	.	S	Bend	trans	61.8	174.3	-178.9	-86	-171.3	171.8	-173.1	-2.2	115.2	G500	G500-R502 PolarHBondContact O-N 2.88Å
503	D	51.6	Low	50.7	Low	85 Å²	85	87.2 Å²	87.2	46%	0.455	46%	0.462	S	S	.	.			trans	-76.2	125.1	-144	-116.5	-19.9	0	0	0	114.1	L505 E506 R513	D503-L505 PolarHBondContact O-N 3.46Å; D503-E506 PolarHBondContact O-N 3.18Å; D503-R513 IonicContact OD2-NH2 3.6Å; D503-R513 PolarHBondContact OD2-NH2 3Å
504	P	51.4	Low	50	Low	62 Å²	62	84.4 Å²	84.4	40%	0.403	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	36.9	-177	37.2	-39.7	0	0	0	113.2
505	L	44.9	Very low	49.4	Very low	47 Å²	47	88.9 Å²	88.9	25%	0.246	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	2	-177.6	-83.1	164.5	0	0	0	112.2	D503 S514 R517	D503-L505 PolarHBondContact O-N 3.46Å; L505-S514 PolarHBondContact O-N 3.16Å; L505-S514 PolarHBondContact O-OG 3.49Å; L505-R517 HydrophobicContact CD2-CG 3.52Å; L505-R517 HydrophobicContact CG-CG 4.22Å
506	E	49.2	Very low	48.7	Very low	78 Å²	78	91.6 Å²	91.6	36%	0.364	48%	0.48	S	S	.	.	S	Bend	trans	-126.9	132.9	-175.2	-165.4	169.9	133.6	0	0	109.6	D503 N508 R513	D503-E506 PolarHBondContact O-N 3.18Å; E506-N508 PolarHBondContact O-N 3.16Å; E506-R513 HydrophobicContact CB-CG 4.29Å; E506-R513 HydrophobicContact CG-CB 4.39Å; E506-R513 HydrophobicContact CG-CG 4.25Å; E506-R513 IonicContact OE2-NE 2.67Å; E506-R513 PolarHBondContact OE2-NE 3.37Å; E506-R513 VanDerWaalsContact OE2-NE 3.09Å
507	C	50.1	Low	48	Very low	7 Å²	7	96.2 Å²	96.2	5%	0.047	50%	0.495	C	S	.	.			trans	-76.1	106.1	178.6	-167.7	0	0	0	0	110.4	I509 C510 G511 Y512 F520	C507-I509 PolarHBondContact O-N 3.39Å; C507-C510 WeakPolarHBondContact CB-SG 3.22Å; C507-C510 PolarHBondContact O-N 2.82Å; C507-C510 PolarHBondContact SG-SG 2.89Å; C507-G511 WeakPolarHBondContact O-CA 3.48Å; C507-G511 PolarHBondContact O-N 3.17Å; C507-Y512 WeakPolarHBondContact CB-O 3.22Å; C507-Y512 PolarHBondContact N-O 2.82Å; C507-F520 HydrophobicContact CB-CE2 3.51Å; C507-F520 HydrophobicContact CB-CZ 3.98Å
508	N	48.8	Very low	47.4	Very low	153 Å²	153	104.1 Å²	104.1	82%	0.818	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-5.4	173.4	-69.3	-42.5	0	0	0	114.5	E506	E506-N508 PolarHBondContact O-N 3.16Å
509	I	41.2	Very low	47	Very low	155 Å²	155	103.6 Å²	103.6	80%	0.795	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-39	179.1	-58.2	175.4	0	0	0	112.1	C507	C507-I509 PolarHBondContact O-N 3.39Å
510	C	41.2	Very low	46.8	Very low	62 Å²	62	101.9 Å²	101.9	42%	0.419	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	4.5	-174.1	66.4	0	0	0	0	115.2	C507 Y512 H529	C507-C510 WeakPolarHBondContact CB-SG 3.22Å; C507-C510 PolarHBondContact O-N 2.82Å; C507-C510 PolarHBondContact SG-SG 2.89Å; C510-Y512 PolarHBondContact O-N 3.2Å; C510-H529 VanDerWaalsContact SG-CE1 3.57Å
511	G	43.8	Very low	46.9	Very low	49 Å²	49	102.1 Å²	102.1	51%	0.505	49%	0.487	S	S	.	.			trans	67.8	-2.7	-178.8	0	0	0	0	0	115.2	C507 R513	C507-G511 WeakPolarHBondContact O-CA 3.48Å; C507-G511 PolarHBondContact O-N 3.17Å; G511-R513 PolarHBondContact O-N 2.7Å
512	Y	43.2	Very low	46.9	Very low	113 Å²	113	97.5 Å²	97.5	44%	0.443	48%	0.475	S	S	.	.			trans	-62.7	126.4	178.5	-175.4	-100	0	0	0	110.8	C507 C510	C507-Y512 WeakPolarHBondContact CB-O 3.22Å; C507-Y512 PolarHBondContact N-O 2.82Å; C510-Y512 PolarHBondContact O-N 3.2Å
513	R	51.3	Low	46.9	Very low	154 Å²	154	90.4 Å²	90.4	58%	0.581	45%	0.451	S	S	*	.			trans	-115.3	83.4	-173.5	-159.8	176.1	-159.6	-124.9	-4.8	109.4	D503 E506 G511	D503-R513 IonicContact OD2-NH2 3.6Å; D503-R513 PolarHBondContact OD2-NH2 3Å; E506-R513 HydrophobicContact CB-CG 4.29Å; E506-R513 HydrophobicContact CG-CB 4.39Å; E506-R513 HydrophobicContact CG-CG 4.25Å; E506-R513 IonicContact OE2-NE 2.67Å; E506-R513 PolarHBondContact OE2-NE 3.37Å; E506-R513 VanDerWaalsContact OE2-NE 3.09Å; G511-R513 PolarHBondContact O-N 2.7Å
514	S	48.9	Very low	46.8	Very low	4 Å²	4	90.8 Å²	90.8	3%	0.028	45%	0.451	C	S	.	.			trans	-58	141.1	176.7	56.8	0	0	0	0	110.5	L505 D516	L505-S514 PolarHBondContact O-N 3.16Å; L505-S514 PolarHBondContact O-OG 3.49Å; S514-D516 VanDerWaalsContact C-N 3.29Å; S514-D516 WeakPolarHBondContact CB-O 3.47Å; S514-D516 PolarHBondContact OG-O 3.1Å
515	Q	51.6	Low	46.6	Very low	188 Å²	188	93.9 Å²	93.9	88%	0.879	47%	0.469	S	S	*	.	S	Bend	trans	-73.2	-26.2	170.4	-70.4	179.1	-11.9	0	0	111.3
516	D	47	Very low	46.6	Very low	106 Å²	106	99.5 Å²	99.5	57%	0.567	49%	0.487	S	S	*	.	S	Bend	trans	-126.9	139.4	177.4	-111.9	-47.9	0	0	0	115.4	S514 Y518 E519	S514-D516 VanDerWaalsContact C-N 3.29Å; S514-D516 WeakPolarHBondContact CB-O 3.47Å; S514-D516 PolarHBondContact OG-O 3.1Å; D516-Y518 VanDerWaalsContact C-N 3.27Å; D516-Y518 PolarHBondContact O-N 3.34Å; D516-E519 HydrophobicContact CB-CG 4.44Å; D516-E519 PolarHBondContact O-N 3.14Å
517	R	48.1	Very low	46.4	Very low	139 Å²	139	98.6 Å²	98.6	53%	0.525	50%	0.499	S	S	.	.	H	α-helix	trans	-69.6	-21.9	-173.8	-58.5	-175.5	-166.6	-149.2	-0.3	114	L505 S521	L505-R517 HydrophobicContact CD2-CG 3.52Å; L505-R517 HydrophobicContact CG-CG 4.22Å; R517-S521 PolarHBondContact O-N 3.5Å; R517-S521 PolarHBondContact O-OG 2.95Å
518	Y	44.9	Very low	46	Very low	198 Å²	198	103.3 Å²	103.3	78%	0.776	52%	0.52	S	S	*	.	H	α-helix	trans	-78.7	-32.8	179.2	-87.1	-76.6	0	0	0	112.2	D516 S521 S522	D516-Y518 VanDerWaalsContact C-N 3.27Å; D516-Y518 PolarHBondContact O-N 3.34Å; Y518-S521 PolarHBondContact O-OG 3.48Å; Y518-S522 WeakPolarHBondContact O-CB 3.48Å; Y518-S522 PolarHBondContact O-N 3.08Å; Y518-S522 VanDerWaalsContact O-N 3.13Å
519	E	45.4	Very low	45.8	Very low	92 Å²	92	99.9 Å²	99.9	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-48.6	172.6	-62.9	-177.2	131.7	0	0	110.2	D516 S521 S522 H523	D516-E519 HydrophobicContact CB-CG 4.44Å; D516-E519 PolarHBondContact O-N 3.14Å; E519-S521 PolarHBondContact O-N 2.88Å; E519-S522 CarbonylContact O-C 3.55Å; E519-S522 WeakPolarHBondContact O-CA 3.19Å; E519-S522 WeakPolarHBondContact O-CB 3.35Å; E519-S522 PolarHBondContact O-N 3.02Å; E519-S522 PolarHBondContact O-OG 3.28Å; E519-H523 PolarHBondContact O-CD2 3.5Å; E519-H523 PolarHBondContact O-N 2.95Å
520	F	45.3	Very low	45.7	Very low	47 Å²	47	99 Å²	99	21%	0.206	50%	0.501	C	S	.	.	H	α-helix	trans	-54.3	-48.1	179.9	-179.1	-124.7	0	0	0	113.4	C507 S522 I524	C507-F520 HydrophobicContact CB-CE2 3.51Å; C507-F520 HydrophobicContact CB-CZ 3.98Å; F520-S522 VanDerWaalsContact C-N 3.28Å; F520-S522 PolarHBondContact O-N 3.14Å; F520-I524 HydrophobicContact CD1-CD1 4.47Å; F520-I524 HydrophobicContact CD2-CD1 4.08Å; F520-I524 HydrophobicContact CE1-CD1 3.97Å; F520-I524 HydrophobicContact CE2-CD1 3.49Å; F520-I524 VanDerWaalsContact CE2-CD1 3.49Å; F520-I524 HydrophobicContact CE2-CG1 4.31Å; F520-I524 HydrophobicContact CZ-CD1 3.45Å; F520-I524 VanDerWaalsContact CZ-CD1 3.45Å; F520-I524 PolarHBondContact O-N 3.34Å
521	S	45.5	Very low	45.3	Very low	61 Å²	61	105.2 Å²	105.2	43%	0.427	52%	0.521	S	S	.	.	H	α-helix	trans	-70.1	-24.3	176.4	43.9	0	0	0	0	113	R517 Y518 E519 V525	R517-S521 PolarHBondContact O-N 3.5Å; R517-S521 PolarHBondContact O-OG 2.95Å; Y518-S521 PolarHBondContact O-OG 3.48Å; E519-S521 PolarHBondContact O-N 2.88Å; S521-V525 VanDerWaalsContact O-CG2 3.25Å; S521-V525 WeakPolarHBondContact O-CG2 3.46Å; S521-V525 PolarHBondContact O-N 3.1Å
522	S	44.4	Very low	44.8	Very low	38 Å²	38	115 Å²	115	27%	0.266	55%	0.553	S	S	.	*	H	α-helix	trans	-79.4	-38.2	175	83.3	0	0	0	0	114	Y518 E519 F520 V525 R526	Y518-S522 WeakPolarHBondContact O-CB 3.48Å; Y518-S522 PolarHBondContact O-N 3.08Å; Y518-S522 VanDerWaalsContact O-N 3.13Å; E519-S522 CarbonylContact O-C 3.55Å; E519-S522 WeakPolarHBondContact O-CA 3.19Å; E519-S522 WeakPolarHBondContact O-CB 3.35Å; E519-S522 PolarHBondContact O-N 3.02Å; E519-S522 PolarHBondContact O-OG 3.28Å; F520-S522 VanDerWaalsContact C-N 3.28Å; F520-S522 PolarHBondContact O-N 3.14Å; S522-V525 PolarHBondContact O-N 2.88Å; S522-R526 WeakPolarHBondContact O-CG 3.18Å; S522-R526 PolarHBondContact O-N 3.08Å; S522-R526 PolarHBondContact OG-NH1 3.04Å
523	H	48.1	Very low	44.8	Very low	61 Å²	61	115.2 Å²	115.2	28%	0.282	56%	0.559	S	S	.	*	H	α-helix	trans	-68.1	-39.3	177.4	-76.1	-64.3	0	0	0	112.1	E519 V525 R526 G527 E528	E519-H523 PolarHBondContact O-CD2 3.5Å; E519-H523 PolarHBondContact O-N 2.95Å; H523-V525 VanDerWaalsContact C-N 3.32Å; H523-V525 PolarHBondContact O-N 3.03Å; H523-R526 PolarHBondContact O-N 2.75Å; H523-G527 PolarHBondContact O-N 3.25Å; H523-E528 IonicContact CE1-OE2 3.45Å; H523-E528 PolarHBondContact CE1-OE2 3.12Å; H523-E528 IonicContact CG-OE2 3.99Å; H523-E528 IonicContact ND1-OE2 2.65Å; H523-E528 PolarHBondContact ND1-OE2 3.49Å
524	I	48.3	Very low	44.5	Very low	92 Å²	92	113.1 Å²	113.1	47%	0.472	56%	0.558	S	S	.	*	H	α-helix	trans	-61.1	-41.6	173.4	-72.4	170.8	0	0	0	111.1	F520 R526 G527	F520-I524 HydrophobicContact CD1-CD1 4.47Å; F520-I524 HydrophobicContact CD2-CD1 4.08Å; F520-I524 HydrophobicContact CE1-CD1 3.97Å; F520-I524 HydrophobicContact CE2-CD1 3.49Å; F520-I524 VanDerWaalsContact CE2-CD1 3.49Å; F520-I524 HydrophobicContact CE2-CG1 4.31Å; F520-I524 HydrophobicContact CZ-CD1 3.45Å; F520-I524 VanDerWaalsContact CZ-CD1 3.45Å; F520-I524 PolarHBondContact O-N 3.34Å; I524-R526 VanDerWaalsContact C-N 3.34Å; I524-G527 PolarHBondContact O-N 3.11Å
525	V	47.1	Very low	44.3	Very low	128 Å²	128	119.2 Å²	119.2	78%	0.776	59%	0.587	S	S	*	*	H	α-helix	trans	-72.8	-25.2	178.5	170.2	0	0	0	0	112.7	S521 S522 H523	S521-V525 VanDerWaalsContact O-CG2 3.25Å; S521-V525 WeakPolarHBondContact O-CG2 3.46Å; S521-V525 PolarHBondContact O-N 3.1Å; S522-V525 PolarHBondContact O-N 2.88Å; H523-V525 VanDerWaalsContact C-N 3.32Å; H523-V525 PolarHBondContact O-N 3.03Å
526	R	45.8	Very low	43.8	Very low	165 Å²	165	115.1 Å²	115.1	62%	0.623	57%	0.57	S	S	*	*	H	α-helix	trans	-84.6	-15.6	174.5	-72.2	-175.6	177.8	110.8	-3.9	114.5	S522 H523 I524 E528	S522-R526 WeakPolarHBondContact O-CG 3.18Å; S522-R526 PolarHBondContact O-N 3.08Å; S522-R526 PolarHBondContact OG-NH1 3.04Å; H523-R526 PolarHBondContact O-N 2.75Å; I524-R526 VanDerWaalsContact C-N 3.34Å; R526-E528 VanDerWaalsContact C-N 3.35Å; R526-E528 HydrophobicContact CB-CG 3.84Å; R526-E528 WeakPolarHBondContact CD-OE1 3.16Å
527	G	43.4	Very low	43.6	Very low	59 Å²	59	115.7 Å²	115.7	61%	0.608	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.4	20.1	176.9	0	0	0	0	0	114.9	H523 I524 H529	H523-G527 PolarHBondContact O-N 3.25Å; I524-G527 PolarHBondContact O-N 3.11Å; G527-H529 PolarHBondContact O-N 2.67Å; G527-H529 VanDerWaalsContact O-N 3.11Å
528	E	42.4	Very low	43.3	Very low	105 Å²	105	114.1 Å²	114.1	49%	0.491	57%	0.573	S	S	.	*			trans	-76.8	5.7	-169.5	-68.6	162.5	168.2	0	0	114.6	H523 R526 T530	H523-E528 IonicContact CE1-OE2 3.45Å; H523-E528 PolarHBondContact CE1-OE2 3.12Å; H523-E528 IonicContact CG-OE2 3.99Å; H523-E528 IonicContact ND1-OE2 2.65Å; H523-E528 PolarHBondContact ND1-OE2 3.49Å; R526-E528 VanDerWaalsContact C-N 3.35Å; R526-E528 HydrophobicContact CB-CG 3.84Å; R526-E528 WeakPolarHBondContact CD-OE1 3.16Å; E528-T530 PolarHBondContact O-N 2.65Å
529	H	45.2	Very low	43.2	Very low	81 Å²	81	108.1 Å²	108.1	38%	0.375	56%	0.559	S	S	.	*			trans	-87.9	92.9	174.6	-73.5	-55.7	0	0	0	111.4	C510 G527	C510-H529 VanDerWaalsContact SG-CE1 3.57Å; G527-H529 PolarHBondContact O-N 2.67Å; G527-H529 VanDerWaalsContact O-N 3.11Å
530	T	39.8	Very low	43	Very low	136 Å²	136	109.4 Å²	109.4	83%	0.834	57%	0.569	S	S	*	*			trans	-72.2	134.2	163.2	44	0	0	0	0	110.6	E528	E528-T530 PolarHBondContact O-N 2.65Å
531	F	31.8	Very low	42.9	Very low	193 Å²	193	114.6 Å²	114.6	85%	0.846	60%	0.599	S	S	*	*			trans	-76.7	137.3	172.8	-73	-97.7	0	0	0	110
532	H	32.5	Very low	42.6	Very low	256 Å²	256	119.5 Å²	119.5	100%	1.185	61%	0.614	S	S	*	*			trans	-150.3	0	169.3	-137.3	-40.8	0	0	0	113.4

Retrieved 532 of 532 residues in 234.2 ms (Link to these results)

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